data_2ma9_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 2ma9 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 N-CA-C 111.92 -0.472 . . . . 10.0 111.92 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -62.49 1.78 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.24 -31.03 72.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.606 -178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -54.65 -36.45 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.066 0.46 . . . . 10.0 110.972 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -93.45 -39.97 10.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.453 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.42 -29.56 70.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.684 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.27 -40.95 98.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.795 0.331 . . . . 10.0 110.984 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.4 tp -68.04 -31.87 71.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.206 0.527 . . . . 10.0 109.83 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.12 15.71 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.448 -0.796 . . . . 10.0 110.3 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.78 -39.27 2.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.952 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.94 122.6 1.61 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.906 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.3 mt -89.15 87.51 2.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.3 tttt -100.85 111.33 63.01 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.286 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.96 45.11 0.09 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.332 2.688 . . . . 10.0 111.595 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -95.27 175.77 6.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.131 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.36 152.43 27.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.1 0.476 . . . . 10.0 111.52 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.8 mm -113.51 141.82 28.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.879 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -160.65 144.59 10.26 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -38.5 136.04 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.331 2.687 . . . . 10.0 112.88 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.11 134.53 53.23 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 123.119 2.546 . . . . 10.0 112.82 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.24 123.32 87.92 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.254 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.26 -12.72 36.15 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 123.087 2.525 . . . . 10.0 113.074 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -39.54 94.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.122 0.487 . . . . 10.0 110.124 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.2 t -126.82 -118.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.91 63.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.525 . . . . 10.0 110.476 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -157.36 153.28 27.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.241 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 pp -74.14 148.23 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.736 0.303 . . . . 10.0 110.534 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 m -81.45 163.87 22.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.254 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -111.72 102.22 10.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.748 0.308 . . . . 10.0 110.513 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -150.67 -82.34 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.301 -0.408 . . . . 10.0 110.613 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.42 ' C ' ' HE ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.36 -54.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.65 -0.691 . . . . 10.0 109.74 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tmm? . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 121.013 0.435 . . . . 10.0 110.774 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.56 146.67 30.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.813 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 84.7 t -131.59 118.78 40.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 121.121 0.486 . . . . 10.0 111.362 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -108.68 113.86 27.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.94 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.16 159.43 36.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.829 0.347 . . . . 10.0 111.581 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 60.9 mtm -127.01 109.02 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.845 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.5 mm -81.69 103.23 8.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -101.34 110.94 23.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.382 0.882 . . . . 10.0 113.382 -178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ttp85 -96.18 59.49 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.42 -1.326 . . . . 10.0 107.42 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 66.3 -83.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.948 -1.023 . . . . 10.0 112.112 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -93.22 -7.59 44.73 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.282 0.475 . . . . 10.0 112.282 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.0 m -120.84 108.41 13.9 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.738 0.273 . . . . 10.0 111.738 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 28.2 m -103.06 120.65 41.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 10.0 110.384 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 44.5 mt -108.01 118.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.735 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -77.19 118.56 19.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.61 124.32 52.06 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.119 0.485 . . . . 10.0 111.221 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -110.71 97.63 7.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.36 -167.82 1.62 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.829 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -126.33 164.21 21.54 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.47 -22.96 62.3 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -85.61 -5.23 59.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 13.5 m -82.24 142.71 31.91 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 38.1 p -90.99 165.38 13.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.779 0.323 . . . . 10.0 110.921 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 76.7 t -65.62 -34.45 70.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.215 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -61.4 -36.09 79.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.455 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -62.69 -38.38 90.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.722 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.38 -42.99 99.6 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.013 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.425 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 99.4 mttt -62.88 -37.46 86.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.62 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -65.82 -34.92 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.041 179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 95.2 mt -66.98 -46.31 85.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.04 -37.13 77.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.746 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.56 -39.98 85.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.671 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.6 -1.54 77.37 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.926 -0.654 . . . . 10.0 113.312 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 82.6 mt -114.41 -53.6 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.887 0.375 . . . . 10.0 111.398 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 60.7 mt -90.38 -6.84 54.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.591 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mptt 60.07 38.81 20.35 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.152 0.501 . . . . 10.0 111.678 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -116.42 133.1 23.02 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.463 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -57.18 133.83 60.12 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 123.073 2.516 . . . . 10.0 112.255 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.5 -22.81 58.43 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.249 2.633 . . . . 10.0 112.614 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -61.5 -37.15 82.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.35 -1.02 57.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.784 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -85.44 135.68 33.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.921 0.391 . . . . 10.0 111.159 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 65.1 mmt-85 -128.0 116.35 19.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.004 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 71.7 mt -98.84 118.44 35.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.034 0.445 . . . . 10.0 111.05 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -115.55 112.44 22.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.491 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -112.78 132.14 55.38 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.68 30.02 19.61 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.107 0.479 . . . . 10.0 110.412 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 68.37 24.19 7.35 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.234 -0.894 . . . . 10.0 111.587 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -130.92 151.47 51.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.127 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.33 130.05 34.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.751 0.31 . . . . 10.0 111.034 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.93 156.58 24.68 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -99.22 121.99 41.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.739 0.304 . . . . 10.0 110.527 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.425 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 8.5 m-20 -58.51 -29.31 66.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.646 -0.706 . . . . 10.0 112.399 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.57 2.53 84.76 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.002 -0.618 . . . . 10.0 112.872 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -106.94 154.27 21.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.986 0.422 . . . . 10.0 111.177 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 22.5 p -88.78 162.56 16.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.165 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 mt -56.98 -36.83 70.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.597 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -34.5 87.14 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.239 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -83.65 -14.12 52.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.049 0.452 . . . . 10.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.8 m -95.34 6.46 48.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.108 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.96 33.3 37.24 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.404 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -94.93 55.09 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.096 0.474 . . . . 10.0 110.618 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.19 148.42 48.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m -60.68 -16.77 42.63 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.77 -26.91 34.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.957 0.408 . . . . 10.0 110.341 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.87 -38.87 12.06 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.21 82.69 2.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.985 -1.007 . . . . 10.0 108.883 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.55 158.21 34.1 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.769 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.69 -15.81 30.18 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.319 2.013 . . . . 10.0 110.696 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -94.29 -16.57 23.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.939 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.41 93.7 1.41 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.119 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -72.99 149.73 47.42 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.928 2.419 . . . . 10.0 112.086 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.58 116.29 10.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.017 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.21 115.78 16.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.147 0.499 . . . . 10.0 111.777 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.09 133.46 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -81.68 130.06 9.45 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.017 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 36.7 tp -109.74 108.42 18.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.982 0.42 . . . . 10.0 111.197 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.74 123.64 46.05 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.652 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -101.11 118.27 36.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -76.29 121.37 22.86 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.09 0.472 . . . . 10.0 111.658 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.87 149.3 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -79.22 133.69 36.68 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.981 -0.288 . . . . 10.0 110.726 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 t70 75.31 -32.84 0.22 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.894 0.701 . . . . 10.0 112.894 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.8 m -69.53 110.9 5.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.961 0.41 . . . . 10.0 110.562 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -84.96 7.35 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.032 0.444 . . . . 10.0 111.61 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.64 -28.04 68.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.26 92.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.97 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -60.57 -30.62 69.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.541 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 44.2 m -70.08 -26.95 64.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.625 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 mt -101.11 2.11 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.832 0.348 . . . . 10.0 111.235 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.49 110.04 44.4 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.202 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -62.27 -16.12 49.06 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 123.055 2.503 . . . . 10.0 111.93 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -79.14 1.63 23.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.605 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 16.6 m -142.72 -45.71 0.31 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.501 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 22.3 m -108.38 133.74 20.47 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.081 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.87 153.63 47.9 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.378 2.052 . . . . 10.0 110.672 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -50.01 120.08 5.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.008 2.472 . . . . 10.0 111.915 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -60.53 121.79 13.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.603 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.1 tp -144.91 122.98 6.54 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 10.0 109.903 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.59 133.78 47.48 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.626 2.217 . . . . 10.0 111.153 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.21 -35.88 78.39 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 23.0 m -69.54 -18.42 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.112 0.482 . . . . 10.0 111.041 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 93.7 mmm -110.2 27.91 9.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.506 0.669 . . . . 10.0 109.35 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -103.22 -49.73 0.15 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.471 -0.786 . . . . 10.0 113.005 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.09 51.09 3.03 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.828 2.352 . . . . 10.0 112.16 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -123.47 177.3 5.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.594 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.03 -174.4 2.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.728 0.299 . . . . 10.0 111.512 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -93.76 158.31 15.73 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.9 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.6 -137.96 8.28 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.938 -0.648 . . . . 10.0 112.751 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -17.87 22.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.856 0.36 . . . . 10.0 111.532 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 74.7 m -148.86 -174.43 4.62 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.062 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.64 151.19 42.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.67 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.2 t30 73.14 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.354 0.872 . . . . 10.0 113.354 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.28 133.72 42.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.044 0.449 . . . . 10.0 111.702 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -117.09 159.1 23.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.639 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.0 106.29 12.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.946 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 t -73.04 123.97 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.128 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.325 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.972 0.415 . . . . 10.0 110.868 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -114.19 106.11 13.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.606 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 64.1 mt -89.89 141.37 28.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.671 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.98 121.55 58.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -95.78 169.69 9.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.946 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -25.19 65.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.038 -0.528 . . . . 10.0 112.424 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -82.18 6.18 17.4 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.667 0.27 . . . . 10.0 111.382 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.99 23.25 76.69 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 10.0 111.638 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -94.67 124.98 39.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -96.53 137.58 35.39 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.266 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -125.69 113.87 17.91 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.257 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -92.94 116.99 35.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.725 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -103.6 134.64 44.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.686 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -66.1 128.42 36.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 19.0 ttt-85 -54.57 -27.6 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.821 0.674 . . . . 10.0 112.821 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -57.2 -41.78 80.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.022 0.439 . . . . 10.0 110.702 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 -85.69 -32.7 21.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.206 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.16 91.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.552 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.46 -44.96 85.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.832 0.349 . . . . 10.0 111.089 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -36.12 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.664 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -66.4 -34.41 77.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.095 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.07 -22.32 75.91 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.31 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -71.47 -28.41 63.92 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.293 0.568 . . . . 10.0 110.216 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 20.9 mt -84.47 141.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -65.38 100.24 0.47 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.931 0.396 . . . . 10.0 110.7 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -101.46 178.01 4.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.491 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 21.6 mmm -78.22 26.33 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 58.5 mt -74.41 -29.93 61.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.151 0.5 . . . . 10.0 110.256 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -90.44 -0.14 57.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.026 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.93 -62.21 5.7 Favored Glycine 0 CA--C 1.52 0.378 0 CA-C-N 115.765 -0.652 . . . . 10.0 113.348 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.36 174.45 3.41 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.666 2.244 . . . . 10.0 112.52 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.98 -62.12 6.01 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.989 -0.624 . . . . 10.0 112.391 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -130.5 125.9 35.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.808 0.337 . . . . 10.0 111.212 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -109.75 75.7 0.96 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.47 165.8 9.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.332 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -53.54 -39.39 64.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.907 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.08 -39.43 92.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.886 0.374 . . . . 10.0 110.516 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.16 -26.27 65.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.637 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -79.06 -17.87 54.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.315 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -90.78 -55.69 3.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.11 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -110.45 96.4 6.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 t -95.1 103.1 14.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.075 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -95.33 122.16 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.085 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -104.21 139.82 38.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.703 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -109.27 138.58 45.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.747 0.308 . . . . 10.0 111.297 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 68.97 8.26 6.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.387 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 85.1 mt -108.54 108.7 61.17 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.277 -0.419 . . . . 10.0 110.501 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.62 149.49 84.02 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.941 2.427 . . . . 10.0 112.046 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 2.6 p -60.28 -38.69 84.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.437 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -55.5 30.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.228 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 21.7 m -66.99 -34.44 69.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.238 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.57 -35.54 81.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.549 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 46.5 m -61.47 -42.55 98.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.551 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -64.52 -36.74 85.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.39 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 96.1 t -64.75 -46.85 90.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.71 -41.63 97.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.994 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 44.1 mtm -65.81 -39.58 91.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.511 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -65.27 -41.36 94.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.036 -0.357 . . . . 10.0 110.036 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.6 -46.99 85.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.901 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 32.8 m -58.16 -46.51 85.57 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.722 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -61.37 -46.81 88.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.63 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -61.62 -38.05 86.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.509 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.58 -44.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.093 0.473 . . . . 10.0 110.417 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.3 mmt85 -78.28 -41.38 34.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.153 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -57.29 -49.03 77.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.919 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.04 15.18 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.915 0.388 . . . . 10.0 111.437 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -119.09 -75.86 0.58 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.628 0.251 . . . . 10.0 111.078 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.66 17.48 5.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 10.0 111.635 -179.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 66.2 m -126.25 32.32 5.24 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.021 0.438 . . . . 10.0 111.246 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.88 3.48 33.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 10.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.69 -23.49 49.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.874 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 47.4 pt -94.87 164.59 19.11 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.608 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -73.48 169.63 21.84 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.394 2.063 . . . . 10.0 111.706 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.62 163.73 10.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.788 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -46.95 131.7 8.82 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.969 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -57.94 113.27 1.45 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.962 2.442 . . . . 10.0 111.656 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 40.0 pt -78.71 45.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.742 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.3 -58.01 0.38 Allowed Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -79.98 108.93 2.3 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.202 1.934 . . . . 10.0 111.169 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.93 62.01 2.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.479 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 4.3 mm -119.15 4.28 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.27 0.557 . . . . 10.0 110.611 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -28.74 52.94 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.15 -0.344 . . . . 10.0 111.128 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 12.6 tp -70.38 -29.8 66.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.476 -0.564 . . . . 10.0 109.476 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -61.99 -33.95 75.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.184 -0.916 . . . . 10.0 109.608 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.63 -32.62 60.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.495 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 52.0 tp -69.45 -17.57 63.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.71 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.72 -21.74 66.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.704 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.93 -31.44 72.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.74 -56.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.312 0.856 . . . . 10.0 113.312 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -86.11 56.23 3.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.112 0.482 . . . . 10.0 111.185 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.879 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 112.213 -0.355 . . . . 10.0 112.213 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.42 -53.67 5.82 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 122.483 0.313 . . . . 10.0 111.797 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.7 tp -59.92 -28.64 67.77 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.959 0.409 . . . . 10.0 110.57 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -55.87 -28.97 59.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.132 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -107.11 -36.36 6.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.468 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.07 -40.97 91.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.906 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.28 -34.49 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.883 0.373 . . . . 10.0 111.223 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.65 -38.36 90.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.85 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.64 -11.48 59.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.164 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -34.5 14.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.846 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.01 112.31 2.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.098 0.475 . . . . 10.0 111.122 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -81.65 90.91 2.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.8 tttt -101.03 106.96 47.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.273 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -94.7 35.77 0.17 Allowed 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.337 2.691 . . . . 10.0 111.91 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.5 mttm -89.85 175.43 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.113 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -75.42 159.85 30.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.185 0.517 . . . . 10.0 112.022 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.6 mm -115.79 138.23 46.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.917 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -163.96 138.73 4.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -38.91 144.77 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.783 2.989 . . . . 10.0 113.678 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.66 154.01 74.53 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.985 2.457 . . . . 10.0 112.785 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.88 126.29 56.1 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.276 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.23 -19.31 63.22 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.272 2.648 . . . . 10.0 112.703 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -35.99 82.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.754 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -130.18 -128.75 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -156.1 59.76 0.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 10.0 110.441 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.5 tttm -155.66 152.35 28.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.737 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.4 pp -74.0 160.04 31.86 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.674 0.273 . . . . 10.0 110.927 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.31 162.69 12.72 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.104 -178.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.57 111.45 23.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.699 -0.228 . . . . 10.0 110.874 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -164.14 -77.57 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.251 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.97 -53.56 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.691 0.62 . . . . 10.0 110.167 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.817 0 CA-C-O 118.301 -0.856 . . . . 10.0 109.691 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.909 0.385 . . . . 10.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -79.39 131.62 36.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.3 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 90.9 t -118.52 112.99 40.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.184 0.516 . . . . 10.0 110.871 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -100.2 116.49 32.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.797 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -129.53 159.62 35.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 10.0 111.763 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 15.6 mtm -125.57 105.33 8.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.811 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.6 mm -81.15 107.16 13.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -107.39 105.02 14.75 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -92.35 74.86 5.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.803 -1.555 . . . . 10.0 106.803 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 67.29 -82.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.433 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -111.29 -10.54 14.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.796 0.332 . . . . 10.0 111.105 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -92.06 94.95 9.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.565 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.4 m -98.17 112.92 24.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.06 0.457 . . . . 10.0 110.624 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 51.0 mt -107.02 119.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.85 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -78.33 119.41 21.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -112.06 118.34 35.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.3 0.571 . . . . 10.0 111.942 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -103.27 94.81 5.71 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -118.44 -168.57 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.842 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 mmtt -127.17 165.47 19.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -63.36 -22.43 66.87 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.814 0.301 . . . . 10.0 111.814 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 2.7 m -83.1 -8.51 59.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.8 m -77.38 136.77 38.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.077 -0.342 . . . . 10.0 110.077 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 21.1 p -86.14 161.45 18.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.31 -36.53 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.999 0.428 . . . . 10.0 110.337 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -63.99 -30.45 71.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.486 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.69 -35.39 80.62 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.272 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 47.6 mt -60.95 -42.43 98.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.496 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 87.6 mttt -61.96 -36.83 82.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.309 179.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -66.13 -39.16 89.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.949 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -65.73 -48.25 83.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 10.0 109.872 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -63.39 -37.51 79.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.422 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.84 -37.75 80.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.185 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.28 -17.99 79.58 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.938 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.42 -52.15 9.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.983 0.421 . . . . 10.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 34.6 mt -81.44 -17.6 48.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.684 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 63.16 36.47 12.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.802 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -127.87 147.59 63.6 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.76 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.78 130.25 18.77 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.912 3.075 . . . . 10.0 114.134 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.47 -18.37 15.72 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.846 2.364 . . . . 10.0 111.766 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -65.16 -36.04 82.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.13 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -88.12 0.95 55.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.626 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.22 133.06 34.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.901 0.381 . . . . 10.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -123.3 110.04 14.7 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 97.2 mt -91.96 116.2 28.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 10.0 111.534 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -115.19 120.98 41.57 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.02 -0.536 . . . . 10.0 112.027 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 21.0 tttm -121.5 127.26 50.85 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.46 36.98 16.94 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 63.8 20.8 12.39 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.656 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -127.34 146.84 50.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.582 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 tp -79.84 131.67 35.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.341 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 96.6 mt -76.98 156.33 32.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.885 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -95.56 116.51 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.499 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.496 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 50.7 m-20 -59.88 -27.91 67.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.928 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.07 1.5 88.71 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.81 -0.71 . . . . 10.0 113.412 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -113.39 166.3 11.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.583 . . . . 10.0 111.892 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 25.8 p -95.17 171.25 8.85 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.408 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.83 -40.99 97.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.52 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.32 -30.58 71.5 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.397 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.75 -12.35 59.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.771 0.32 . . . . 10.0 111.352 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.3 m -100.69 8.78 43.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.76 0.314 . . . . 10.0 111.556 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.53 1.87 68.22 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.831 -0.7 . . . . 10.0 113.107 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -79.34 106.98 11.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.813 0.339 . . . . 10.0 110.343 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 1.3 p -137.33 174.41 10.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.138 -0.69 . . . . 10.0 109.138 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.11 -3.55 7.76 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.076 0.465 . . . . 10.0 111.537 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -91.18 -42.81 10.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.165 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.49 -34.16 18.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.762 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -106.24 107.45 18.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.483 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 68.9 mtt180 -120.85 158.5 51.98 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.008 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.75 -36.49 82.25 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.132 2.554 . . . . 10.0 113.225 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.84 13.49 24.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 10.0 111.319 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -150.99 75.53 8.21 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.442 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.96 136.75 16.84 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.679 2.252 . . . . 10.0 111.284 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 117.22 8.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.699 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 21.7 m -75.17 126.38 30.91 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.334 0.588 . . . . 10.0 111.63 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 t -122.02 128.19 75.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.164 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.28 126.33 7.36 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -104.92 98.78 8.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.918 0.39 . . . . 10.0 111.121 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.38 116.02 28.57 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -95.97 116.8 29.48 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.691 0.281 . . . . 10.0 110.569 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -74.72 109.22 8.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -130.18 130.64 44.96 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -65.41 136.05 56.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.422 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 20.2 t70 73.1 -7.38 1.51 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.586 -0.734 . . . . 10.0 112.02 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.4 m -95.91 100.38 12.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.094 0.473 . . . . 10.0 109.965 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -72.45 -11.32 60.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.191 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -55.66 -31.67 62.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.358 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.964 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.81 -25.53 59.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.842 0.353 . . . . 10.0 111.185 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -87.67 -30.98 19.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.879 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 54.5 mt -78.61 -33.47 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.17 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.46 115.8 36.35 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-O 120.897 0.38 . . . . 10.0 111.677 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.62 -5.7 16.75 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.471 2.781 . . . . 10.0 112.102 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -68.43 -37.31 80.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.156 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.7 p -108.43 -37.82 5.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.554 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 23.8 m -104.73 141.45 22.57 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.837 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.62 161.78 39.04 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 122.507 2.138 . . . . 10.0 110.719 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.73 135.19 68.28 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.722 2.281 . . . . 10.0 112.398 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -72.79 104.1 3.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 39.4 tp -134.11 121.9 15.9 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.921 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -58.29 127.66 25.63 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.635 2.223 . . . . 10.0 111.665 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.34 -32.83 71.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.362 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.99 -20.23 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.16 0.505 . . . . 10.0 111.192 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 75.3 mmm -113.72 33.16 5.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.846 -0.615 . . . . 10.0 109.638 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -97.25 -54.86 0.2 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 113.092 0.775 . . . . 10.0 113.092 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.09 77.29 2.81 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.554 2.169 . . . . 10.0 112.483 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -139.74 172.37 12.88 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.612 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -89.39 167.38 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.0 m -100.59 135.76 41.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.87 0.367 . . . . 10.0 110.311 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.27 -153.71 12.68 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.792 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.4 p -93.49 -28.71 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 10.0 111.039 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 m -86.04 157.04 20.17 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.616 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.17 122.76 17.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.374 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 72.64 16.7 4.7 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 123.721 0.638 . . . . 10.0 111.791 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -81.88 126.92 32.47 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -105.54 138.9 40.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.462 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.41 106.81 14.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.15 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -74.34 123.5 29.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.725 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.155 179.554 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.236 0.354 0 CA-C-O 120.847 0.356 . . . . 10.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 66.8 tttt -108.43 122.29 46.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 10.0 111.004 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 59.3 mt -99.2 124.99 44.68 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 2.9 mt -108.11 126.52 64.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.3 p -99.46 167.42 10.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.55 -0.295 . . . . 10.0 110.459 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.2 m -66.92 -12.75 60.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 10.0 111.595 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.22 -5.44 59.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.115 0.483 . . . . 10.0 110.266 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.69 16.2 66.42 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.837 -0.697 . . . . 10.0 111.936 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.39 133.22 33.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 10.0 110.573 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -100.52 120.82 40.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.761 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -112.78 114.32 26.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.614 0.245 . . . . 10.0 110.888 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 25.9 mm -98.2 119.97 46.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 16.8 t -106.28 136.99 38.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.793 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 55.5 tttt -60.85 128.92 38.87 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.351 -0.386 . . . . 10.0 109.98 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -52.43 -32.89 41.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.394 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.629 . . . . 10.0 111.137 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -81.54 -31.11 32.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.154 0.502 . . . . 10.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.14 92.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.737 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 61.7 mt -59.7 -48.99 79.47 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.759 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.79 -42.6 99.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.985 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -62.85 -39.1 93.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.547 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.68 -13.56 82.02 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.525 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 33.1 m -75.36 -26.88 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.218 0.533 . . . . 10.0 110.283 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 18.0 mt -83.49 153.32 3.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -64.67 93.24 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.936 0.398 . . . . 10.0 110.429 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -99.58 -178.75 3.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.377 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 67.6 mmm -77.58 28.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.641 0.608 . . . . 10.0 112.641 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.85 -28.41 65.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.094 0.473 . . . . 10.0 110.434 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 m -90.39 3.75 52.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.475 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.61 -64.24 3.43 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.695 -0.684 . . . . 10.0 113.461 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.22 175.19 4.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.6 2.2 . . . . 10.0 112.362 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.24 -33.58 64.68 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.293 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -154.47 136.28 14.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.414 . . . . 10.0 110.861 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -118.45 72.48 0.87 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.43 172.71 8.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.365 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -53.17 -31.19 41.4 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.23 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -62.9 -39.67 95.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.038 0.447 . . . . 10.0 110.378 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.54 -29.12 56.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.608 -0.723 . . . . 10.0 110.62 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -73.3 -27.7 61.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.032 0.444 . . . . 10.0 110.562 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -79.14 -57.81 3.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.755 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -128.61 109.53 11.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.135 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.6 t -94.2 109.78 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.179 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -90.33 110.85 21.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.914 0.387 . . . . 10.0 110.949 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -90.14 125.45 35.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -99.14 136.6 38.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.344 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 64.33 25.15 13.42 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.686 0.617 . . . . 10.0 111.278 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 79.1 mt -124.66 103.91 31.16 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.514 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.04 154.98 58.45 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.289 2.659 . . . . 10.0 112.346 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 13.2 p -65.02 -35.76 82.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -55.4 -57.06 13.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 10.0 112.226 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.8 m -66.71 -35.76 75.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.388 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 21.4 tp -64.5 -38.95 92.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.742 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 58.9 m -60.74 -41.54 95.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.38 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -64.49 -38.33 90.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.624 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.03 -44.76 91.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.074 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.3 m -60.73 -44.33 96.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.803 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.5 mtm -66.62 -36.79 83.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.569 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -64.7 -41.91 95.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.041 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.19 -44.72 95.96 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.79 -0.448 . . . . 10.0 109.79 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 24.2 m -60.09 -41.41 92.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.749 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -63.45 -44.69 93.77 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.555 -0.748 . . . . 10.0 109.806 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -63.26 -40.14 96.58 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.371 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.87 -48.28 88.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.275 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 mmt85 -72.67 -38.7 67.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.378 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -57.68 -53.72 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.959 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.2 43.21 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.496 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -155.39 -54.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.174 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.91 -40.12 0.95 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.033 0.444 . . . . 10.0 111.506 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -83.31 53.35 2.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.011 0.434 . . . . 10.0 111.455 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.38 -1.12 45.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.266 0.555 . . . . 10.0 110.342 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.55 -22.56 22.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.056 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 36.5 pt -90.94 160.98 36.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.03 176.95 9.49 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.156 1.904 . . . . 10.0 112.819 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -67.12 170.22 7.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.975 -1.011 . . . . 10.0 109.74 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -50.24 130.91 24.52 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.475 -0.329 . . . . 10.0 111.084 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.23 125.11 17.78 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.928 2.419 . . . . 10.0 112.621 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 17.5 pt -80.57 52.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -109.51 -56.34 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.475 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.13 106.15 1.31 Allowed 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.968 1.779 . . . . 10.0 112.046 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.46 59.35 0.6 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.105 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 10.6 mm -120.48 -7.31 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.573 . . . . 10.0 110.639 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.77 -35.42 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.741 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 23.9 tp -67.82 -36.15 79.87 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.5 -35.75 81.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.116 -0.947 . . . . 10.0 109.64 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.56 -35.62 65.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.209 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.33 -23.56 67.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.725 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.6 ttp -60.47 -22.04 63.04 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.107 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.52 -34.56 77.13 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.449 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.17 -65.31 0.19 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 124.096 0.873 . . . . 10.0 113.131 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -82.46 55.67 3.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.413 0.625 . . . . 10.0 110.622 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--O 1.246 0.919 0 CA-C-N 115.163 -0.926 . . . . 10.0 108.75 179.606 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.428 -0.269 . . . . 10.0 112.428 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -63.14 1.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -179.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.2 tp -61.02 -27.94 68.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.329 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -52.6 -34.1 49.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.105 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -106.47 -35.0 7.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.885 0.374 . . . . 10.0 110.648 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 61.6 mt -59.34 -45.9 90.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.921 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.673 0.273 . . . . 10.0 111.03 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.5 tp -64.22 -37.51 87.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.272 0.558 . . . . 10.0 110.082 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.51 -15.02 53.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.638 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.82 -32.71 31.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.32 114.98 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.618 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.0 pt -81.01 94.18 2.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.363 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -108.8 95.26 16.37 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.657 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -84.39 78.99 2.66 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.105 2.537 . . . . 10.0 110.936 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -130.05 -170.49 2.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.387 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 49.1 mm-40 -94.16 164.71 12.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.669 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.3 mm -114.56 159.23 14.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.058 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 179.92 142.0 0.34 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -40.68 135.47 2.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.243 2.629 . . . . 10.0 112.044 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.52 137.15 58.21 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.827 2.351 . . . . 10.0 112.388 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.01 118.33 34.62 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.069 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.62 -22.18 73.84 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.053 2.502 . . . . 10.0 112.617 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.03 -14.55 59.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.046 -0.524 . . . . 10.0 111.2 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.1 -138.63 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.282 -179.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -154.66 49.23 0.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 10.0 110.085 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -149.55 147.93 28.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.445 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.28 159.38 32.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.718 0.294 . . . . 10.0 111.158 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.72 169.04 9.53 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.429 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -115.86 120.17 38.36 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.298 -0.26 . . . . 10.0 110.298 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -162.55 -65.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.127 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.07 -57.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.957 -1.127 . . . . 10.0 107.957 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 114.695 -1.139 . . . . 10.0 109.191 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tmm? . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.692 0.282 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.03 134.52 45.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.373 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.43 120.19 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 121.208 0.528 . . . . 10.0 111.707 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -109.84 114.71 28.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.199 179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 160.95 32.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.843 0.354 . . . . 10.0 111.56 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 46.6 mtm -129.61 107.2 9.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.011 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -81.91 102.4 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -101.18 103.41 14.45 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.3 ttp85 -88.66 71.26 8.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 177.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 68.02 -81.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.193 -0.912 . . . . 10.0 111.098 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -107.28 -16.32 14.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.903 0.382 . . . . 10.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.09 97.69 10.11 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.102 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 4.3 m -97.24 115.66 28.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.886 0.374 . . . . 10.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.92 118.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.105 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -77.93 120.8 23.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -114.05 121.97 45.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.091 0.472 . . . . 10.0 111.976 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.96 98.25 7.85 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.06 -1.089 . . . . 10.0 108.06 178.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.77 -167.75 1.63 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.324 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -126.22 160.61 29.81 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -60.81 -20.62 61.96 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 12.7 m -86.73 -7.91 57.86 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m -78.11 142.59 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 31.6 p -90.19 164.06 14.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.787 0.327 . . . . 10.0 110.794 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 75.4 t -63.26 -39.31 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.369 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -61.59 -32.27 72.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.22 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.96 -38.81 89.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.633 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -60.68 -42.42 97.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.033 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.421 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 94.9 mttt -64.84 -35.41 81.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.967 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -66.79 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 77.7 mt -73.18 -46.3 51.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.52 -34.72 62.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.521 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.07 -37.38 71.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.864 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.22 -5.71 89.87 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.905 -0.664 . . . . 10.0 113.072 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -105.15 -49.09 9.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.985 0.421 . . . . 10.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.32 -8.54 54.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.412 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 79.0 mttt 56.92 46.48 19.5 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.377 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -142.64 143.09 24.8 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.576 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.84 133.56 45.69 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.438 2.758 . . . . 10.0 113.488 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.94 -16.08 32.63 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.033 2.489 . . . . 10.0 111.957 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.54 -29.05 70.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.434 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -96.09 3.12 53.56 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.946 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.98 132.74 35.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 111.207 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -123.86 115.89 22.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.073 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 83.4 mt -93.41 123.09 36.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.163 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -117.26 119.47 35.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.519 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -125.1 134.19 52.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 57.74 34.71 24.78 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.296 0.372 . . . . 10.0 110.623 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 65.97 16.14 10.35 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.682 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -123.89 159.76 28.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.825 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.1 tp -87.89 134.32 33.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 85.8 mt -80.71 152.2 28.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.14 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -92.96 118.47 31.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.143 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.421 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 16.3 m-20 -60.25 -26.96 66.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.66 3.74 85.03 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.738 -0.744 . . . . 10.0 113.118 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -108.23 164.99 11.83 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.152 0.501 . . . . 10.0 111.574 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.2 p -96.34 169.71 9.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.675 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.1 mt -62.37 -39.08 92.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.543 -0.298 . . . . 10.0 111.146 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.15 -39.28 94.27 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.031 -0.604 . . . . 10.0 112.594 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -75.02 -24.28 58.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 10.0 110.958 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 63.9 m -85.86 4.44 37.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.766 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.37 14.64 61.61 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.668 -0.777 . . . . 10.0 113.413 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -87.4 67.23 9.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.968 0.413 . . . . 10.0 110.14 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -95.01 161.89 13.95 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 24.8 m -65.83 -7.63 17.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 10.0 111.56 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -74.71 -48.54 25.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.313 0.578 . . . . 10.0 109.578 178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.03 -40.5 18.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.453 -0.794 . . . . 10.0 109.971 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -95.46 100.41 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.55 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -115.39 159.42 38.37 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.707 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -58.38 -19.26 42.55 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.881 2.388 . . . . 10.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.41 8.25 14.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.061 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -153.14 84.51 4.41 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.597 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -78.31 137.47 15.05 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.844 2.362 . . . . 10.0 111.33 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.12 115.97 9.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.3 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.18 123.32 21.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.441 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.41 135.58 62.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.49 135.14 12.95 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.684 -0.77 . . . . 10.0 111.695 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.3 tp -116.81 99.92 7.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.96 0.41 . . . . 10.0 111.552 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.87 125.28 37.4 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -106.46 125.36 50.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.699 0.285 . . . . 10.0 110.96 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -75.31 112.18 11.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.061 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.36 139.82 48.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.34 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -77.98 145.1 36.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.392 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 61.14 15.85 6.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.041 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.5 m -127.7 107.99 10.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.638 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -87.25 4.99 40.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.613 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.9 -28.71 67.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.419 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.57 68.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.02 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.3 mt -71.36 -28.0 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.895 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 19.1 m -80.99 -25.82 36.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.245 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 mt -91.36 -9.83 10.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.024 0.44 . . . . 10.0 110.817 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -91.45 107.52 22.35 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.641 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -68.59 -11.85 33.06 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 10.0 111.582 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -71.23 -38.22 71.98 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.211 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -100.74 -45.75 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.205 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -106.53 155.35 38.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.771 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 160.81 30.82 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.507 2.138 . . . . 10.0 111.632 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.83 139.85 70.59 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.413 2.075 . . . . 10.0 111.923 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -70.98 96.33 1.29 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.216 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 34.0 tp -130.46 122.84 20.07 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.95 179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -66.01 141.24 63.38 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.902 2.402 . . . . 10.0 111.896 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.79 -35.05 79.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.53 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.31 -23.38 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.154 0.502 . . . . 10.0 111.012 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.2 mmm -113.88 59.19 0.67 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . 0.424 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 34.1 ttpt -138.33 -50.88 0.02 OUTLIER Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.565 -0.743 . . . . 10.0 112.269 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . 0.424 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 12.5 Cg_exo -73.65 50.6 2.07 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.877 2.385 . . . . 10.0 112.199 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -124.02 160.01 28.6 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.851 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.91 175.5 9.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.894 0.378 . . . . 10.0 111.497 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.9 m -99.82 137.69 37.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.511 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.75 -133.44 2.33 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.432 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.57 -43.3 5.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.037 0.446 . . . . 10.0 111.285 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 15.0 m -81.57 161.23 23.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.271 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 135.59 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.58 0.13 3.55 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.668 0.605 . . . . 10.0 111.391 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.39 115.83 19.26 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.936 0.398 . . . . 10.0 110.421 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -96.98 138.47 34.46 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.069 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.31 108.29 16.73 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.959 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.3 126.57 39.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.372 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.053 179.507 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.966 0.412 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -106.39 117.8 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.051 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.44 123.96 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 20.6 mt -111.51 118.57 57.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -93.38 166.59 12.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.439 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -9.79 29.75 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -87.91 4.25 45.49 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.863 0.363 . . . . 10.0 110.652 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.91 23.89 73.49 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.563 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -96.98 128.23 43.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 10.0 110.659 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -101.08 118.39 36.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.387 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -109.8 117.27 33.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.767 0.317 . . . . 10.0 111.048 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.4 mm -100.22 113.42 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.72 136.54 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.47 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -59.59 128.61 37.86 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.27 -0.641 . . . . 10.0 109.27 178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -56.38 -28.34 58.92 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -57.19 -51.97 67.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 10.0 110.196 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -73.63 -29.61 62.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.097 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -33.48 76.11 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.073 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.84 -47.46 84.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.231 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 1.1 m -66.01 -36.34 83.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.833 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 23.3 m -68.26 -17.93 64.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.441 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -86.55 -16.17 62.5 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.063 -0.815 . . . . 10.0 111.063 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.9 m -83.55 -28.55 28.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.351 0.596 . . . . 10.0 109.639 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.11 141.96 15.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -70.38 88.46 0.65 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.356 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -99.06 177.05 5.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.396 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 89.2 mmm -80.07 36.97 0.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.74 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 tp -68.15 -30.33 69.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.415 0.626 . . . . 10.0 109.368 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.63 15.93 10.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.286 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.91 -64.03 3.36 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.525 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.65 169.5 12.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.565 2.176 . . . . 10.0 111.926 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.96 -52.73 50.48 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.116 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -139.08 116.62 11.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.825 0.345 . . . . 10.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -84.84 93.22 8.45 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.18 165.91 23.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.986 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -59.98 -25.35 65.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.313 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.17 -37.9 88.84 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -74.27 -30.54 62.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.046 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.69 -22.35 58.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.322 0.582 . . . . 10.0 109.74 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -83.63 -61.88 1.72 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.148 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -130.8 109.33 10.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.512 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -90.7 119.98 38.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.856 -179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -93.61 114.41 26.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.9 0.381 . . . . 10.0 110.689 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -103.95 99.09 8.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.359 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -89.12 147.0 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.053 -0.522 . . . . 10.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 69.75 17.91 7.59 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.698 0.624 . . . . 10.0 111.21 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.3 mt -124.73 109.52 28.14 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.895 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.91 144.52 99.45 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.048 2.499 . . . . 10.0 112.02 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.4 p -62.12 -36.76 82.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.19 -55.35 32.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.811 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.7 m -66.27 -36.26 76.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.865 -0.334 . . . . 10.0 111.214 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -63.89 -36.45 83.96 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.329 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -62.37 -41.7 98.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.058 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -66.11 -37.64 86.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.171 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.59 -44.72 98.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 61.5 m -61.25 -42.7 99.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.433 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.4 mtm -65.15 -37.78 88.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.474 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -65.15 -43.76 90.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.403 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -61.48 -44.03 97.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.003 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 27.0 m -58.77 -43.31 90.37 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.943 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -65.13 -43.77 90.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.145 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -62.57 -40.4 96.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.293 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 44.0 t -58.82 -50.89 77.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.447 . . . . 10.0 109.911 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -69.8 -38.78 76.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.353 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -57.87 -46.35 84.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 10.0 110.822 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.62 18.72 3.78 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.343 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -125.62 -49.5 1.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.868 0.366 . . . . 10.0 111.553 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.72 -31.24 0.39 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.982 0.42 . . . . 10.0 111.774 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 6.7 m -81.44 31.7 0.34 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.403 0.519 . . . . 10.0 112.403 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.45 -12.63 60.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.339 0.59 . . . . 10.0 110.215 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -77.16 -30.32 54.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.37 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 36.7 pt -84.25 165.0 40.98 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -70.95 167.58 25.57 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.403 2.069 . . . . 10.0 112.872 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -66.4 165.19 14.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.209 -0.905 . . . . 10.0 109.607 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -46.16 126.41 7.3 Favored Pre-proline 0 C--O 1.233 0.223 0 O-C-N 123.56 0.538 . . . . 10.0 111.32 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -51.21 119.72 5.81 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.097 2.532 . . . . 10.0 112.598 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 12.8 pt -79.58 47.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.729 -0.668 . . . . 10.0 110.872 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -96.49 -55.87 0.2 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -71.15 107.78 2.19 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.032 1.822 . . . . 10.0 111.88 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.79 59.87 1.64 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.741 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.3 mm -120.78 -2.66 8.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.268 0.556 . . . . 10.0 110.462 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.7 -34.02 76.06 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.149 -0.344 . . . . 10.0 111.862 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 28.4 tp -66.11 -35.56 80.82 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.279 0.561 . . . . 10.0 109.797 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -63.17 -34.4 77.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.254 -0.885 . . . . 10.0 109.717 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 82.0 mt -73.82 -31.87 63.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.925 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 97.1 mt -67.24 -17.05 64.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.055 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.6 ttp -69.46 -13.96 62.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.18 -33.32 74.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.932 -0.396 . . . . 10.0 109.932 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.84 -67.84 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.288 0.847 . . . . 10.0 113.288 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -83.89 42.5 0.86 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 10.0 111.437 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.246 0.873 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 179.583 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -60.03 4.32 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.4 tp -62.91 -29.03 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 10.0 112.012 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -58.96 -33.37 70.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 10.0 111.125 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -95.93 -37.79 10.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.454 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.69 -45.9 87.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.425 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.07 -28.25 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 10.0 111.308 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.88 -33.09 75.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 10.0 110.373 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.91 -13.03 40.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.243 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.98 -35.49 23.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.708 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 tp -159.62 122.44 3.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.371 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.1 mt -89.31 88.11 2.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -99.18 102.86 17.12 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.179 0.437 . . . . 10.0 112.179 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -89.48 93.1 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.162 2.575 . . . . 10.0 110.261 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -157.2 177.49 11.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.462 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 45.3 mm-40 -87.36 152.38 22.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.96 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.2 mm -118.13 107.14 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.27 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.9 tttp -117.68 144.32 34.09 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -32.3 133.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 124.265 3.31 . . . . 10.0 113.742 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.2 138.15 70.4 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 123.105 2.537 . . . . 10.0 112.701 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.76 124.79 91.16 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.404 179.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.63 -10.36 28.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.218 2.612 . . . . 10.0 112.912 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -36.84 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.861 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.24 -103.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.399 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -178.33 63.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.899 0.48 . . . . 10.0 111.112 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -156.09 145.03 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.05 149.5 44.81 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.12 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 m -84.67 137.7 33.1 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -97.28 80.85 2.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.108 0.48 . . . . 10.0 110.564 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -125.87 -75.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.601 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.85 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.468 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.666 -0.683 . . . . 10.0 109.396 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 mmm . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.666 0.27 . . . . 10.0 111.177 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.82 131.02 3.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.144 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t -134.93 121.8 35.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.962 0.41 . . . . 10.0 111.004 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -111.26 121.01 44.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.719 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.6 160.19 39.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.811 0.339 . . . . 10.0 111.366 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 37.3 mtm -126.45 108.42 11.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.043 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -80.44 103.6 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -98.97 102.64 14.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -90.46 69.59 6.88 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.228 -1.397 . . . . 10.0 107.228 177.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 68.57 -77.05 0.05 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.888 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -112.06 -20.9 11.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.892 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -90.5 101.0 13.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.773 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 3.0 m -100.48 117.19 34.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.949 0.404 . . . . 10.0 110.812 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -107.27 116.75 51.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.02 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -76.82 118.32 19.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.4 m -110.31 117.92 34.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.122 0.487 . . . . 10.0 111.529 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -108.73 103.73 12.88 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.131 -1.063 . . . . 10.0 108.131 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -135.05 -159.66 0.98 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.902 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -129.73 167.91 17.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 -64.81 -23.55 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.909 0.385 . . . . 10.0 110.793 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -16.76 63.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.547 -0.751 . . . . 10.0 111.798 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.7 m -78.46 145.54 34.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.746 0.308 . . . . 10.0 110.725 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 16.7 p -98.39 163.81 12.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.311 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.6 -38.09 77.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 110.491 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -61.18 -31.8 71.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.515 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -72.38 -28.12 62.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.772 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.6 mt -65.9 -41.4 91.54 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.556 ' HZ2' ' CG ' ' B' ' 53' ' ' ASP . 91.2 mttt -60.46 -36.65 78.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.95 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -63.71 -41.01 98.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.144 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -65.77 -47.04 87.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.022 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.32 -40.6 89.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.209 0.528 . . . . 10.0 110.234 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.58 -38.71 92.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.875 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.86 -15.01 66.34 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.735 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.4 mt -103.69 -50.07 9.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 10.0 111.48 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 65.9 mt -83.51 -20.94 33.01 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.635 0.605 . . . . 10.0 112.635 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt 57.77 53.49 7.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.213 0.53 . . . . 10.0 111.61 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 73.4 mtt-85 -139.9 154.51 70.72 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.636 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.48 121.72 6.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.55 2.834 . . . . 10.0 113.766 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.28 -18.44 20.68 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.868 2.379 . . . . 10.0 112.645 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -70.49 -25.01 62.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.826 0.346 . . . . 10.0 111.846 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -95.68 3.31 54.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -84.06 102.53 12.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.783 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 64.1 mmt-85 -89.65 97.86 11.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.135 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 87.5 mt -82.11 111.29 18.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.31 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -110.25 115.62 30.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -124.39 137.22 54.48 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.231 -1.026 . . . . 10.0 108.231 178.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 61.71 26.4 16.06 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.253 0.346 . . . . 10.0 110.329 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 72.66 12.47 5.39 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.159 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -127.05 162.27 26.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.382 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.7 tp -82.35 133.64 35.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.587 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 74.5 mt -77.94 146.76 35.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.73 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -94.49 122.26 36.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 10.0 111.592 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.556 ' CG ' ' HZ2' ' B' ' 28' ' ' LYS . 9.1 m-20 -60.88 -26.79 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.218 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.47 11.98 59.98 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.508 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mttp -126.12 153.86 43.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.005 0.431 . . . . 10.0 111.19 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 34.8 p -84.45 170.09 13.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.807 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.08 -39.39 89.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.4 -0.363 . . . . 10.0 111.072 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.21 96.21 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.64 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -69.94 -19.14 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.858 0.361 . . . . 10.0 111.332 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.28 10.26 22.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.933 0.397 . . . . 10.0 111.475 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.82 51.49 5.87 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.654 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -114.99 78.62 1.18 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.925 0.393 . . . . 10.0 110.486 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -92.21 168.09 11.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -11.41 57.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.14 0.495 . . . . 10.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -83.71 -40.63 18.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.124 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.1 -27.83 26.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.479 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.25 94.85 4.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.573 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -116.04 155.37 48.08 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.769 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.6 -13.39 35.01 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.162 1.908 . . . . 10.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -4.96 22.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.948 -1.024 . . . . 10.0 110.056 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -164.3 93.07 1.01 Allowed Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.965 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -78.14 140.43 17.74 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.8 2.333 . . . . 10.0 110.914 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.61 113.52 4.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.43 122.97 20.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.813 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 53.9 t -120.23 132.61 69.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 108.655 -0.868 . . . . 10.0 108.655 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.86 131.25 10.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.244 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 46.4 tp -109.26 97.05 6.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.964 0.411 . . . . 10.0 111.04 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.78 105.55 17.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.136 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -88.89 105.63 17.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.133 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -77.41 116.93 18.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.318 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -125.06 148.58 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.207 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.85 130.1 42.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.383 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t0 61.9 27.76 16.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.534 0.683 . . . . 10.0 111.382 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 13.6 m -124.16 106.05 10.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.241 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -78.52 -9.63 59.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.859 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.28 -38.42 71.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.948 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.62 74.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.916 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.14 -24.57 65.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.471 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 13.9 m -84.17 -21.19 31.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.913 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 34.5 mt -91.91 -34.45 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.108 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -64.24 115.49 20.04 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.58 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -66.87 -11.06 30.61 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.037 2.491 . . . . 10.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -72.8 -25.86 61.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.765 -0.458 . . . . 10.0 109.765 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.63 -51.4 2.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.597 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 41.9 m -96.55 139.51 21.69 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.396 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.76 166.38 29.03 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.673 2.249 . . . . 10.0 111.181 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.45 115.19 2.3 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.729 2.286 . . . . 10.0 112.281 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -70.31 99.76 1.6 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.931 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 tp -131.83 128.28 21.56 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.336 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.06 124.91 15.82 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.034 2.49 . . . . 10.0 112.151 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.58 -38.79 85.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.459 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 m -67.14 -19.0 24.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.188 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 66.8 mmm -115.71 41.01 2.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -111.65 -53.13 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -73.96 66.5 5.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.587 2.191 . . . . 10.0 112.237 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -134.37 173.98 11.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.711 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . 0.428 ' CB ' HE22 ' B' ' 118' ' ' GLN . 2.2 t70 -87.18 179.84 6.57 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 9.5 m -108.79 148.33 30.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.262 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.75 -150.16 18.82 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.26 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.6 -31.59 15.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.293 0.568 . . . . 10.0 110.458 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.3 m -96.09 163.78 12.97 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.092 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.18 140.55 54.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.18 -8.14 1.04 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.623 0.577 . . . . 10.0 111.73 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.56 125.89 29.93 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -110.27 156.15 21.08 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.977 0.417 . . . . 10.0 111.143 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -123.15 103.3 8.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.045 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.25 126.79 34.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.577 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . 0.428 HE22 ' CB ' ' B' ' 107' ' ' ASP . 15.2 mp0 . . . . . 0 C--O 1.237 0.43 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.193 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.049 0.452 . . . . 10.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -109.71 122.58 47.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.575 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 41.1 mt -99.28 132.26 44.73 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.916 179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 11.2 mt -114.51 119.64 62.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.721 0.296 . . . . 10.0 110.22 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 m -85.55 156.52 20.72 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.319 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.7 m -61.82 -25.13 67.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -9.22 58.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.845 0.355 . . . . 10.0 111.263 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.83 28.87 8.02 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.686 -0.768 . . . . 10.0 112.895 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 8.7 m170 -101.61 145.76 28.62 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.785 -0.244 . . . . 10.0 110.346 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -114.74 130.76 56.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.358 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -122.91 118.85 28.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.496 -0.32 . . . . 10.0 110.801 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.4 mm -102.04 118.58 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 25.3 t -106.84 139.89 26.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 121.229 -0.188 . . . . 10.0 110.77 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -60.26 128.5 37.07 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -54.3 -32.85 57.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.983 0.364 . . . . 10.0 111.983 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.34 -37.98 76.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.016 0.436 . . . . 10.0 110.937 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -86.08 -40.17 16.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.178 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.35 90.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.987 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 72.7 mt -59.65 -46.2 89.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.934 0.397 . . . . 10.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -67.81 -32.35 72.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.527 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 25.7 m -69.12 -34.78 75.59 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.1 -10.5 84.18 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.657 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 7.9 m -81.13 -21.49 39.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.92 -0.771 . . . . 10.0 108.92 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -81.28 154.69 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.247 -1.02 . . . . 10.0 108.247 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -73.53 82.59 1.49 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.992 0.425 . . . . 10.0 110.732 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.52 170.06 10.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.955 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 82.6 mmm -78.89 45.13 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.527 0.565 . . . . 10.0 112.527 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.87 -26.47 62.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.273 0.559 . . . . 10.0 109.554 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.76 6.05 37.01 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.346 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.03 -58.44 14.52 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.432 -0.804 . . . . 10.0 113.338 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.47 -175.48 1.58 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.264 1.976 . . . . 10.0 111.899 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.62 -58.71 5.68 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.69 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -137.23 118.32 14.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.69 0.281 . . . . 10.0 110.282 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -79.79 83.18 5.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.148 0.499 . . . . 10.0 110.049 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.94 158.57 34.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.197 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.9 -27.67 60.98 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.752 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -60.37 -45.24 94.22 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -74.29 -28.91 61.41 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.523 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -67.48 -26.25 66.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 10.0 110.789 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -89.98 -57.63 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -119.44 93.22 4.0 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.791 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.3 t -80.54 108.53 14.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.125 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -92.57 118.25 30.81 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.761 0.315 . . . . 10.0 110.246 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -95.33 138.99 32.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 mmt85 -105.48 135.37 47.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.123 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 62.04 27.46 16.6 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.722 0.638 . . . . 10.0 111.796 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 81.6 mt -124.56 107.06 29.53 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-O 121.072 0.463 . . . . 10.0 111.02 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -70.84 138.38 34.26 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.204 2.603 . . . . 10.0 111.913 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.97 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -34.17 71.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.06 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.4 m -93.59 -27.89 4.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.676 -0.41 . . . . 10.0 110.586 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -67.39 -34.0 76.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.951 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.93 -40.27 92.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.052 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -65.49 -35.38 80.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.403 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.16 -42.98 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 47.1 m -62.86 -41.48 99.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.352 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 60.9 mtm -66.49 -37.14 84.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.614 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -64.02 -44.1 93.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.165 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -61.88 -44.24 97.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.281 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 30.1 m -60.62 -42.54 97.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.836 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -65.19 -42.04 93.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.997 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . 0.452 ' HZ3' ' CD ' ' C' ' 74' ' ' GLU . 20.9 tptt -62.79 -42.62 99.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.523 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 68.3 t -60.03 -46.21 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.605 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -72.4 -38.47 68.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.958 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -59.8 -55.34 35.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.134 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 51.94 1.83 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.989 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -170.14 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.309 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.77 -38.27 1.01 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.326 0.491 . . . . 10.0 112.326 -178.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 2.3 m -83.75 28.44 0.58 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.919 0.39 . . . . 10.0 111.78 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.48 -12.96 61.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.844 0.354 . . . . 10.0 111.0 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -82.74 -20.42 36.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.73 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 40.1 pt -99.42 169.08 8.6 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.758 -0.201 . . . . 10.0 110.463 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.98 173.32 14.17 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.272 1.982 . . . . 10.0 113.002 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . 0.452 ' CD ' ' HZ3' ' C' ' 62' ' ' LYS . 15.4 tp10 -70.12 177.69 3.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.692 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -53.94 127.35 53.46 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -54.4 120.26 7.73 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.76 2.307 . . . . 10.0 112.315 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 12.5 pt -76.16 55.93 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.396 0.617 . . . . 10.0 110.917 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -102.28 -56.69 0.11 Allowed Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.834 -0.621 . . . . 10.0 112.187 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . 0.406 ' C ' ' H ' ' C' ' 81' ' ' ILE . 16.9 Cg_exo -68.19 121.01 7.97 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.691 1.594 . . . . 10.0 110.529 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -77.62 29.02 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . 0.406 ' H ' ' C ' ' C' ' 79' ' ' PRO . 46.9 mm -116.71 96.71 4.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.121 -0.696 . . . . 10.0 109.121 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.14 -40.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.431 -0.804 . . . . 10.0 109.605 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 tp -67.56 -22.77 65.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.617 -0.882 . . . . 10.0 108.617 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 mp0 -64.83 -32.76 74.6 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.812 -1.085 . . . . 10.0 109.164 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 64.9 mt -80.44 -33.55 36.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.297 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.104 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 36.2 ttp -63.61 -16.79 61.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.129 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.28 69.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.093 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.51 -68.65 0.17 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.053 0.76 . . . . 10.0 113.053 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -82.04 45.8 0.95 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 10.0 111.342 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.244 0.809 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 179.614 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 120.719 0.066 . . . . 10.0 112.962 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -68.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.324 0.861 . . . . 10.0 113.324 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.6 -29.14 69.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.351 -178.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.54 -31.41 46.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.116 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -105.07 -42.9 5.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.383 179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -57.88 -41.44 82.51 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.26 70.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.729 0.3 . . . . 10.0 111.788 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 tp -67.75 -31.01 70.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 10.0 111.379 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.3 11.02 7.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.173 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.51 -52.6 1.6 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.011 0.434 . . . . 10.0 110.572 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.3 mt -131.56 94.36 3.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.341 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.9 mt -73.76 100.83 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.885 0.374 . . . . 10.0 110.544 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -103.69 101.8 26.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.59 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -90.3 58.75 1.57 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.988 2.458 . . . . 10.0 111.91 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -110.02 -170.53 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.54 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -87.51 163.45 16.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.1 mm -112.61 144.84 19.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.669 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.33 138.85 0.97 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.006 -0.738 . . . . 10.0 109.006 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -42.74 140.13 3.0 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.198 2.598 . . . . 10.0 112.423 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.14 134.52 34.23 Favored 'Trans proline' 0 N--CA 1.465 -0.147 0 C-N-CA 122.846 2.364 . . . . 10.0 112.229 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.97 119.24 76.32 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.367 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.27 -15.28 33.96 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.286 2.657 . . . . 10.0 113.305 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -32.41 73.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.251 0.548 . . . . 10.0 109.638 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.42 -127.24 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.434 -0.803 . . . . 10.0 108.861 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -163.45 61.21 0.17 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.446 0.641 . . . . 10.0 110.223 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.1 tttm -157.03 150.69 24.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.086 -0.961 . . . . 10.0 108.815 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 pp -73.9 150.56 40.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.782 0.325 . . . . 10.0 110.751 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.5 m -88.06 169.51 11.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.824 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -116.77 121.97 43.1 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.975 -0.379 . . . . 10.0 109.975 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -166.9 -75.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.252 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.413 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 170.96 -47.48 0.01 OUTLIER 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.322 -179.803 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.1 tmm? . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.866 0.365 . . . . 10.0 110.526 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.67 138.71 50.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.141 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.0 t -131.04 120.17 46.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.152 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -109.48 120.71 43.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.472 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.69 159.33 38.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.8 0.333 . . . . 10.0 111.341 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 46.6 mtm -128.74 109.54 11.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.77 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 38.7 mm -82.05 105.19 11.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -104.87 104.58 14.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.07 0.767 . . . . 10.0 113.07 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.3 ttp85 -93.68 81.34 4.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.215 -1.402 . . . . 10.0 107.215 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 65.52 -85.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.353 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -112.69 -13.34 13.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.137 0.494 . . . . 10.0 111.222 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -90.19 103.12 15.83 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -104.13 123.71 47.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.743 0.306 . . . . 10.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.85 118.42 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.751 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -79.54 121.54 25.36 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.5 m -114.73 122.28 45.93 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.245 0.545 . . . . 10.0 111.969 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.97 102.91 12.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.016 -1.105 . . . . 10.0 108.016 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.51 -166.33 1.62 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.952 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -134.9 161.25 35.76 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -58.27 -28.99 65.45 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -10.97 60.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.1 m -85.67 147.1 26.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.388 -0.227 . . . . 10.0 110.388 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 25.4 p -91.67 164.14 13.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.747 0.308 . . . . 10.0 111.05 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.4 t -67.5 -32.67 58.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 10.0 110.179 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -62.09 -35.97 80.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.343 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.58 -35.41 79.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.883 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.33 -40.82 95.64 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.051 0.453 . . . . 10.0 109.859 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -63.21 -35.36 80.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.082 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -69.46 -33.78 73.42 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.802 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.1 mt -67.62 -44.32 86.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 85.9 t -63.83 -36.1 75.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.32 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -61.76 -37.28 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.815 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.36 -13.36 79.89 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.7 -0.762 . . . . 10.0 112.531 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -104.32 -56.09 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 10.0 111.73 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.72 -11.52 58.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.706 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 58.72 42.93 19.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.85 -0.614 . . . . 10.0 112.455 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 48.4 mtt-85 -129.71 141.47 41.93 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.172 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -53.67 130.97 41.57 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.145 2.563 . . . . 10.0 113.104 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.06 -13.65 34.18 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.98 2.453 . . . . 10.0 112.473 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.47 -37.33 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.413 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -96.22 9.56 40.65 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.42 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -90.08 126.49 35.8 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.775 0.321 . . . . 10.0 111.091 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mmt-85 -119.7 113.15 20.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 94.9 mt -94.09 130.13 40.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.954 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -123.01 122.38 38.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.351 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -124.66 133.95 53.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.18 37.74 23.82 Favored 'General case' 0 C--O 1.234 0.27 0 O-C-N 123.458 0.474 . . . . 10.0 111.543 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 64.9 18.37 11.45 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.43 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -129.17 155.31 45.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.176 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 63.7 tp -76.09 138.51 40.84 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.924 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.49 158.51 17.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.645 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.501 ' CG ' ' H ' ' B' ' 53' ' ' ASP . 8.8 t70 -80.36 -160.85 0.32 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.465 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.501 ' H ' ' CG ' ' B' ' 52' ' ' ASP . 1.0 OUTLIER -135.05 -57.05 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.013 0.435 . . . . 10.0 110.322 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.79 -23.35 64.51 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.645 -0.707 . . . . 10.0 113.087 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -69.71 154.66 41.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.784 0.325 . . . . 10.0 110.581 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 40.9 p -86.97 166.79 14.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.238 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 36.5 mt -60.97 -40.81 94.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.81 -28.4 65.7 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.92 -0.657 . . . . 10.0 112.587 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -84.43 -11.58 55.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.803 0.335 . . . . 10.0 111.309 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 38.9 m -103.77 11.88 35.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.058 0.456 . . . . 10.0 111.915 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.04 8.11 69.43 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.337 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -87.86 90.48 8.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.579 -0.365 . . . . 10.0 110.625 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -122.88 167.93 12.92 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.6 m -67.46 -4.43 11.32 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -89.52 -44.62 9.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.98 -33.94 26.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.248 0.547 . . . . 10.0 109.755 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.18 100.58 10.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.295 -0.866 . . . . 10.0 109.196 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -109.9 158.01 36.14 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.959 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.07 -18.5 63.82 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.439 2.093 . . . . 10.0 111.502 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -107.56 4.69 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.362 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -163.62 86.97 1.24 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.782 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -76.27 146.05 27.89 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.829 2.353 . . . . 10.0 111.332 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 117.01 15.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.109 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.3 m -72.84 126.14 29.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.168 0.509 . . . . 10.0 111.656 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.2 133.19 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.01 134.49 12.67 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.695 -0.764 . . . . 10.0 111.759 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.2 tp -110.88 101.75 10.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.888 0.375 . . . . 10.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.08 101.27 12.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -83.96 113.92 21.33 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.714 -0.476 . . . . 10.0 109.714 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -72.3 94.49 1.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.499 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -111.77 120.42 41.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.955 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.03 144.17 55.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.863 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.08 -5.05 2.02 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.737 0.648 . . . . 10.0 111.985 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m -111.98 104.72 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.012 0.434 . . . . 10.0 110.2 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -76.52 -7.92 56.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.87 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -56.97 -32.96 66.6 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.025 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.08 74.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.852 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.74 -29.68 68.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.665 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 21.3 m -78.9 -21.62 47.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.398 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 27.1 mt -89.22 -18.61 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.25 0.548 . . . . 10.0 109.927 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -80.68 111.93 27.31 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.203 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.48 10.82 1.74 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.935 2.424 . . . . 10.0 112.111 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -91.78 -31.88 15.59 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 13.2 m -116.04 -16.36 11.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.323 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.1 m -128.28 147.26 62.89 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.249 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -73.78 156.77 48.44 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.444 2.096 . . . . 10.0 111.65 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.1 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.548 2.165 . . . . 10.0 111.706 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -59.23 114.98 2.9 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.433 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 22.3 tp -138.92 129.69 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.613 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.65 130.32 32.88 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.768 2.312 . . . . 10.0 111.357 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.08 -35.46 80.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.95 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 22.3 m -67.97 -17.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 90.7 mmm -114.2 13.29 17.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.887 0.375 . . . . 10.0 110.746 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -82.12 -50.04 0.85 Allowed Pre-proline 0 CA--C 1.541 0.61 0 N-CA-C 113.198 0.814 . . . . 10.0 113.198 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -76.92 61.47 7.12 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.128 1.885 . . . . 10.0 112.447 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -130.55 150.53 51.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.536 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.87 158.32 29.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.441 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 37.9 m -73.16 138.6 45.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.374 -0.375 . . . . 10.0 110.407 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.72 -118.07 2.27 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.919 -0.658 . . . . 10.0 112.467 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -114.97 -46.29 2.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.986 0.422 . . . . 10.0 111.059 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 17.5 m -70.87 165.93 22.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.234 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.79 120.12 13.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.197 -0.456 . . . . 10.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.2 t30 68.81 31.09 4.54 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.735 0.647 . . . . 10.0 111.014 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -87.1 135.64 33.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.098 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -114.85 127.24 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.036 0.446 . . . . 10.0 111.38 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -100.91 115.32 30.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.539 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.8 t -73.29 118.08 18.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.415 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.135 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.778 0.323 . . . . 10.0 110.929 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -112.44 117.5 32.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.886 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 mt -89.21 135.57 33.5 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 35.9 mt -116.5 121.31 67.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 120.845 0.355 . . . . 10.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.85 165.85 13.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.117 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 14.4 m -64.24 -26.6 68.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.688 0.28 . . . . 10.0 111.646 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -75.4 -3.21 32.43 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.149 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.95 10.56 66.44 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.122 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -79.29 139.9 37.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.833 0.349 . . . . 10.0 110.561 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -111.79 133.78 53.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.679 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.81 111.03 15.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.866 0.365 . . . . 10.0 111.687 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 11.2 mm -93.31 115.77 32.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 15.9 t -102.06 142.09 17.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.502 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -62.21 130.89 47.48 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.756 -0.461 . . . . 10.0 109.756 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -48.17 -42.26 29.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 112.176 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.54 -49.19 75.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.965 0.412 . . . . 10.0 111.385 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -68.91 -36.17 77.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.951 0.405 . . . . 10.0 110.397 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.5 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.365 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.6 -47.96 83.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.03 0.443 . . . . 10.0 110.832 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.2 m -62.85 -45.86 90.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.54 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 15.7 m -65.77 -24.37 66.93 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.056 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.78 -6.55 86.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.042 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 41.2 m -88.05 -28.19 21.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.287 0.565 . . . . 10.0 109.855 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -78.11 150.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.241 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.42 96.9 0.26 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.161 0.505 . . . . 10.0 110.652 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -103.67 176.21 5.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.019 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -83.79 31.43 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.57 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.91 -29.84 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.386 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.8 p -90.57 -0.52 57.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.341 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.39 -56.02 8.15 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-N 115.65 -0.705 . . . . 10.0 114.576 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -60.72 -13.02 24.01 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.988 2.459 . . . . 10.0 114.002 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 124.85 -112.05 1.67 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.766 -0.73 . . . . 10.0 111.961 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -100.22 109.88 22.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.94 0.4 . . . . 10.0 110.038 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -86.55 103.84 15.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.818 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.37 167.29 9.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.408 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -52.77 -27.16 16.68 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -57.93 -33.75 69.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.04 0.448 . . . . 10.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -97.77 -24.92 15.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.264 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -64.69 -33.78 76.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.56 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -70.32 -52.54 22.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.176 0.512 . . . . 10.0 109.93 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -133.9 100.57 4.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.406 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 t -80.38 108.22 13.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.19 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -89.44 124.05 34.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.15 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -104.77 128.62 52.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -101.48 140.69 35.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.006 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 60.11 31.45 20.57 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.304 0.573 . . . . 10.0 111.545 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 92.2 mt -131.21 110.79 15.36 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.499 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -68.88 149.49 72.47 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 123.08 2.52 . . . . 10.0 111.925 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.8 p -65.6 -31.71 72.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.749 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -56.27 -54.4 45.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.631 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.58 -33.61 57.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.767 0.318 . . . . 10.0 111.112 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -64.81 -32.97 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.884 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 56.2 m -59.98 -40.63 89.81 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.806 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -68.01 -35.1 77.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.382 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 44.6 t -66.41 -43.8 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.046 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.418 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 69.9 mtm -67.04 -36.45 82.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.229 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -63.83 -42.61 97.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.497 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.79 -46.21 91.37 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.622 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -58.13 -43.31 87.19 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.451 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -66.41 -45.53 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.473 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 tptt -62.5 -40.89 98.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.419 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 41.5 t -58.45 -44.75 89.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.161 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -74.37 -43.74 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.597 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -54.45 -43.47 71.65 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.905 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.93 14.71 13.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.082 0.468 . . . . 10.0 111.808 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -123.44 -62.28 1.33 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.94 0.348 . . . . 10.0 111.94 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 4.7 m -148.83 38.58 0.83 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.092 0.472 . . . . 10.0 110.711 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 19.7 m -147.75 36.0 0.86 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.17 0.51 . . . . 10.0 110.57 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.07 0.93 55.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.435 0.636 . . . . 10.0 110.108 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -75.91 -29.58 58.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.609 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 pt -94.9 159.53 33.0 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.681 -0.691 . . . . 10.0 109.247 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.81 -175.6 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.452 2.101 . . . . 10.0 112.509 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -68.76 175.91 3.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.248 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -52.4 130.59 43.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.508 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.31 116.34 2.77 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.099 2.532 . . . . 10.0 111.813 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 10.2 mt -78.06 72.2 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.395 0.617 . . . . 10.0 111.272 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -120.4 -59.65 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.287 -0.869 . . . . 10.0 111.419 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.71 102.78 1.63 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.597 1.531 . . . . 10.0 111.28 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.51 69.89 2.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.968 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -119.15 10.62 6.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.426 0.631 . . . . 10.0 110.08 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.35 -35.51 65.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 19.7 tp -66.0 -34.96 79.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.13 -33.7 76.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.592 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 90.1 mt -77.2 -34.15 56.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.715 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.2 -12.13 61.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.768 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 47.7 ttp -62.71 -17.42 60.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 10.0 111.465 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.7 -9.75 58.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.781 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.91 -80.62 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 O-C-N 123.826 0.704 . . . . 10.0 112.421 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -101.8 83.7 2.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.522 0.677 . . . . 10.0 111.84 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.317 -0.843 0 N-CA-C 107.626 -1.25 . . . . 10.0 107.626 178.558 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 112.779 -0.128 . . . . 10.0 112.779 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -67.78 -59.66 3.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.769 0.285 . . . . 10.0 111.414 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.85 -24.05 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.053 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -54.81 -46.31 74.51 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.007 0.432 . . . . 10.0 110.399 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -88.97 -33.66 17.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.504 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.7 mt -59.66 -42.54 93.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.774 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.76 -40.52 79.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.899 0.38 . . . . 10.0 110.626 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.4 tp -66.72 -32.29 73.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.268 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.75 -3.43 56.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.607 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.3 -34.01 9.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.068 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.75 118.19 2.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.8 94.13 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -102.04 104.72 38.03 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -93.81 68.95 0.41 Allowed 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.336 2.691 . . . . 10.0 110.214 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -120.93 -175.66 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.129 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -90.62 155.43 18.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.512 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.7 mm -118.3 126.95 75.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.058 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.66 141.45 16.86 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.508 -0.923 . . . . 10.0 108.508 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.07 129.04 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.879 3.053 . . . . 10.0 113.143 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.01 134.62 65.74 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.21 2.607 . . . . 10.0 112.566 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.64 125.96 90.11 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.034 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -68.91 -12.22 33.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.95 2.433 . . . . 10.0 112.179 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -36.84 84.83 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.849 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.58 -114.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.13 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -168.44 53.64 0.05 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.085 0.469 . . . . 10.0 110.958 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -151.17 152.01 32.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.622 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.96 150.94 40.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.719 0.295 . . . . 10.0 110.708 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -92.9 169.58 10.34 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.343 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -120.12 123.4 43.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 10.0 110.408 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.84 -70.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.666 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.0 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.545 -0.909 . . . . 10.0 108.545 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.125 -0.943 . . . . 10.0 109.09 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.777 0.322 . . . . 10.0 111.259 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -107.98 133.91 51.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 10.0 111.776 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 86.8 t -122.48 116.47 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -102.82 118.27 36.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.545 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.31 158.47 39.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.919 0.39 . . . . 10.0 111.501 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 2.0 mtm -127.49 108.08 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.5 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 45.8 mm -81.07 113.43 20.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -109.97 107.03 16.79 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.721 0.637 . . . . 10.0 112.721 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttp85 -96.97 74.29 2.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 68.31 -82.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.267 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -115.61 -9.37 12.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.963 0.411 . . . . 10.0 110.928 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.2 m -93.15 98.66 11.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.82 128.73 44.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.694 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 69.3 mt -123.42 118.54 54.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.79 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -79.05 124.03 27.89 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.6 m -117.72 125.19 50.2 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.144 0.497 . . . . 10.0 111.707 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.73 99.68 9.01 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.01 -164.26 1.1 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.495 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm -130.22 165.36 22.56 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -62.54 -29.53 70.63 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 57.7 m -78.43 -7.62 57.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m -76.85 130.27 37.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 36.6 p -82.9 162.34 21.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.72 0.295 . . . . 10.0 110.769 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 78.1 t -63.94 -32.39 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.91 0.386 . . . . 10.0 110.451 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.38 -32.84 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.209 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.56 -33.51 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.435 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.63 -46.0 91.68 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.473 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 91.8 mttt -61.82 -35.5 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.453 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.3 mtp180 -63.24 -38.21 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 10.0 109.998 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.1 -45.21 80.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.791 -0.641 . . . . 10.0 110.065 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.86 -38.57 82.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.419 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -58.93 -37.89 77.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.538 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.51 1.13 83.46 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.966 -0.561 . . . . 10.0 113.028 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 98.9 mt -113.52 -55.13 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.859 0.361 . . . . 10.0 110.772 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.09 -12.32 57.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.543 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt 58.48 49.98 9.92 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.91 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 57.1 mtt-85 -138.94 143.67 38.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.166 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.31 124.26 11.54 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.355 2.703 . . . . 10.0 113.069 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.52 -16.52 27.21 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.804 2.336 . . . . 10.0 111.156 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.42 -29.11 69.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.011 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -98.29 5.49 48.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.893 0.378 . . . . 10.0 111.437 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -88.37 133.21 34.15 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.519 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 49.3 mmt-85 -119.65 114.88 22.87 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.53 120.88 37.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.618 -0.265 . . . . 10.0 110.382 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -117.29 130.41 56.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -135.06 133.97 39.88 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 62.83 29.73 16.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.397 0.436 . . . . 10.0 110.57 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 72.23 6.17 5.47 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.309 -0.859 . . . . 10.0 111.852 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -120.77 161.77 20.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.1 tp -77.85 145.04 36.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.844 0.354 . . . . 10.0 111.319 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 34.9 mt -87.69 151.43 22.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.932 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -97.07 108.51 21.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.124 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.473 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 1.5 m-20 -51.06 -44.34 61.14 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 113.337 0.865 . . . . 10.0 113.337 -178.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -70.58 -7.16 60.56 Favored Glycine 0 CA--C 1.518 0.245 0 CA-C-N 116.13 -0.486 . . . . 10.0 114.226 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -102.6 162.18 13.13 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 117.107 0.453 . . . . 10.0 111.106 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 38.2 p -90.73 167.23 12.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.081 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 33.7 mt -59.93 -40.95 90.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.621 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.54 -37.23 88.21 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.055 -0.593 . . . . 10.0 112.201 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.96 -9.85 59.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.647 0.26 . . . . 10.0 111.512 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.6 m -102.71 8.66 39.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.987 0.422 . . . . 10.0 111.036 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.95 65.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.29 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -87.08 76.79 9.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.94 0.4 . . . . 10.0 110.334 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.23 155.56 17.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.165 -0.471 . . . . 10.0 109.762 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 5.1 m -66.08 -11.97 52.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 10.0 111.376 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -75.76 -28.36 58.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.018 0.437 . . . . 10.0 110.465 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.25 -48.49 4.37 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.08 82.02 6.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.204 -0.907 . . . . 10.0 109.307 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -94.4 158.88 34.97 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.963 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.95 -16.08 51.8 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.537 2.158 . . . . 10.0 111.925 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -105.69 2.92 28.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.411 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -160.83 82.98 2.01 Favored Pre-proline 0 C--O 1.233 0.235 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.878 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.41 132.57 25.93 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.712 2.275 . . . . 10.0 111.473 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.54 119.53 8.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.784 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.93 124.45 26.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.928 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.0 130.89 74.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.53 131.19 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.709 -0.758 . . . . 10.0 111.924 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.4 tp -113.9 110.75 20.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.422 . . . . 10.0 111.363 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -106.79 124.38 49.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.683 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -105.41 114.08 28.04 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 -71.64 113.53 8.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.031 0.443 . . . . 10.0 111.243 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -127.73 130.1 48.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.563 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . 0.411 ' C ' ' H ' ' B' ' 84' ' ' THR . 39.0 t70 -59.95 134.9 57.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.409 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.7 t70 71.27 -10.44 0.79 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.336 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.411 ' H ' ' C ' ' B' ' 82' ' ' ASP . 5.0 m -100.03 100.39 11.26 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.167 0.508 . . . . 10.0 110.276 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -77.21 1.13 19.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.7 -0.682 . . . . 10.0 112.28 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.29 -33.01 68.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.943 0.401 . . . . 10.0 110.27 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.14 82.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.238 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 91.0 mt -75.32 -7.09 53.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.567 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 18.6 m -96.85 -27.88 14.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.061 0.458 . . . . 10.0 110.344 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -88.07 -31.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.481 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.27 114.65 14.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.573 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.3 -22.37 72.1 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.091 2.527 . . . . 10.0 111.827 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -67.95 -26.75 66.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.267 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -106.57 -40.0 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.881 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 74.1 m -128.82 136.16 28.72 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.539 0.209 . . . . 10.0 110.941 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.43 155.38 62.7 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.709 2.273 . . . . 10.0 111.812 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.19 133.32 41.43 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.107 2.538 . . . . 10.0 112.591 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.57 104.45 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.856 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 33.4 tp -131.19 124.21 20.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.221 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.55 138.08 73.39 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.812 2.341 . . . . 10.0 111.923 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.11 -38.74 87.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.003 0.43 . . . . 10.0 111.309 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.8 m -65.25 -18.23 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.241 0.543 . . . . 10.0 111.049 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.7 mmm -113.81 44.34 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 70.1 tttt -120.29 -51.26 0.04 OUTLIER Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.631 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.42 55.26 4.11 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.223 1.949 . . . . 10.0 112.48 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -127.25 148.78 50.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.244 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -74.77 160.11 31.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 17.8 m -90.31 136.49 33.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.478 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.98 -135.05 2.34 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.187 -0.53 . . . . 10.0 113.262 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.62 -53.08 4.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.861 0.363 . . . . 10.0 111.376 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 23.7 m -70.64 159.81 33.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.398 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.42 127.12 30.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.989 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 t30 71.95 17.79 5.15 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.806 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.41 120.12 21.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -100.32 124.28 45.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.072 0.463 . . . . 10.0 111.258 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.59 97.1 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.86 128.29 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.303 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.974 179.88 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.234 0.244 0 CA-C-O 120.902 0.382 . . . . 10.0 110.828 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -105.29 107.57 18.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.742 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -91.33 113.64 25.96 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 5.5 mt -102.89 122.91 55.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.601 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.0 p -94.38 167.66 11.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -9.37 29.18 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.099 0.407 . . . . 10.0 112.099 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -86.61 -4.83 59.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.134 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.99 17.57 69.55 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.253 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.45 126.17 39.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -94.95 134.31 37.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.717 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -123.4 104.89 9.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.77 0.319 . . . . 10.0 111.106 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.4 mm -88.69 115.75 29.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.403 -0.591 . . . . 10.0 109.403 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 41.8 t -105.86 127.78 60.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.622 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -54.99 129.4 37.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.29 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 32.4 ttt-85 -57.45 -30.86 65.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 10.0 112.038 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.16 -43.15 73.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.052 0.453 . . . . 10.0 110.644 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -81.33 -41.74 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.614 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.26 -33.78 65.79 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.733 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.35 -44.93 92.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.85 0.357 . . . . 10.0 110.379 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 4.2 m -65.25 -46.42 80.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.417 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -37.43 86.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.924 0.392 . . . . 10.0 110.524 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.47 -17.77 74.82 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 116.064 -0.516 . . . . 10.0 112.09 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -80.65 -25.93 37.99 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 41.3 mt -79.41 154.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.413 -0.812 . . . . 10.0 108.931 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -71.8 87.64 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.006 0.432 . . . . 10.0 111.319 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.49 179.69 5.45 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.316 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.29 36.02 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.986 0.422 . . . . 10.0 111.48 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 9.9 tp -66.98 -31.71 72.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.326 0.584 . . . . 10.0 109.845 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 9.72 24.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.348 -0.842 . . . . 10.0 110.589 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.61 -64.47 3.69 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.877 -0.602 . . . . 10.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.61 177.11 7.22 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.694 2.262 . . . . 10.0 111.477 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.19 -77.6 0.27 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.969 -0.634 . . . . 10.0 112.215 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -117.21 116.88 28.14 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 10.0 110.521 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -95.3 89.87 5.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.82 164.43 26.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.198 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.8 -26.52 58.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.023 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -59.11 -52.76 64.34 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -72.63 -20.28 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.319 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 7.1 m -71.76 -29.6 64.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 10.0 110.69 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -93.03 -33.46 14.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.732 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -135.5 98.81 4.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.04 0.447 . . . . 10.0 110.301 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 t -90.38 132.4 35.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.314 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -106.44 115.15 29.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.478 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -104.1 112.88 26.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.511 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -102.86 148.19 25.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.15 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 70.13 14.59 7.69 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.687 0.617 . . . . 10.0 110.725 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 69.5 mt -125.19 108.27 27.41 Favored Pre-proline 0 N--CA 1.455 -0.203 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.38 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.24 150.75 83.19 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.122 2.548 . . . . 10.0 112.384 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.2 p -61.46 -39.81 92.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -52.86 -56.52 15.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 10.0 112.66 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 m -65.2 -35.9 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.929 -0.308 . . . . 10.0 111.255 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -66.0 -35.21 79.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -61.19 -43.32 99.07 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.37 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -65.92 -35.85 81.77 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.218 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 78.4 t -64.12 -46.51 93.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.539 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.8 -42.52 99.11 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.624 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.53 -37.8 83.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.664 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -63.73 -44.03 94.76 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.995 -0.372 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -62.9 -44.21 96.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 58.6 m -57.83 -45.02 86.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.321 0.581 . . . . 10.0 109.783 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -65.56 -44.84 85.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.072 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -60.49 -40.64 92.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.296 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.0 -48.48 84.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.458 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -74.01 -39.01 63.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.242 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -58.01 -45.57 86.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.416 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.41 23.95 2.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.131 0.491 . . . . 10.0 110.667 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -128.86 -62.41 1.01 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.57 -25.52 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -83.61 34.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.275 0.472 . . . . 10.0 112.275 -179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -6.5 59.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.567 0.698 . . . . 10.0 109.658 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -65.87 -26.48 67.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.738 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 23.0 pt -102.77 164.72 15.02 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.639 . . . . 10.0 109.437 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.8 -170.85 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.458 2.105 . . . . 10.0 112.717 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -72.09 165.88 23.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.655 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -48.66 128.15 13.77 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 123.463 0.477 . . . . 10.0 111.011 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -50.14 121.89 8.34 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 123.104 2.536 . . . . 10.0 112.586 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 19.7 pt -79.04 52.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.669 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.34 -56.47 0.16 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.182 -0.463 . . . . 10.0 112.214 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.21 117.4 5.09 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.616 1.544 . . . . 10.0 111.022 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -73.67 -2.61 23.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 39.7 mm -81.62 72.73 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.594 0.711 . . . . 10.0 110.604 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -137.89 -38.23 0.58 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.218 -0.901 . . . . 10.0 109.424 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 12.0 tp -67.97 -24.73 65.19 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.945 -0.761 . . . . 10.0 108.945 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -62.98 -31.76 72.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.699 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 54.6 mt -77.66 -32.4 53.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.649 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -22.09 63.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.386 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.1 ttp -66.6 -19.71 65.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.332 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.68 -34.28 77.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.986 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.39 -56.97 0.5 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.959 0.787 . . . . 10.0 112.54 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -82.49 41.31 0.7 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.144 0.497 . . . . 10.0 110.592 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.241 0.647 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 112.475 -0.25 . . . . 10.0 112.475 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -65.22 0.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.2 tp -61.31 -30.96 70.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.022 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -54.73 -29.7 54.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.944 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -105.09 -37.32 6.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.587 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.6 mt -64.06 -44.6 91.96 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.12 -30.32 66.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 10.0 111.298 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.8 tp -66.27 -35.69 81.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.163 0.506 . . . . 10.0 110.254 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.28 -2.43 52.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.002 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -100.99 -23.2 14.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.3 tp -169.46 109.77 0.44 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.099 -0.5 . . . . 10.0 111.075 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.8 mt -82.92 83.69 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -92.35 111.37 50.15 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.394 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -91.97 38.82 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.12 2.547 . . . . 10.0 112.554 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -93.48 166.13 12.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.772 0.32 . . . . 10.0 110.844 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -82.93 156.54 23.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -106.67 143.7 17.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.287 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.31 140.77 11.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -36.08 131.52 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.802 3.001 . . . . 10.0 113.052 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.18 144.05 91.56 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.432 2.755 . . . . 10.0 113.25 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mt -75.41 122.02 86.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.896 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.81 -23.28 75.89 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 123.037 2.492 . . . . 10.0 112.897 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -31.18 72.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.151 0.5 . . . . 10.0 110.47 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.46 -139.33 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.227 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -149.89 60.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.329 0.585 . . . . 10.0 110.352 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.4 tttm -154.64 150.55 27.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.894 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.98 152.65 41.27 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.837 0.351 . . . . 10.0 111.453 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 m -90.32 168.37 11.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.837 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -114.49 107.75 15.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.782 0.325 . . . . 10.0 110.68 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -157.94 -82.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.337 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.6 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 O-C-N 123.482 0.489 . . . . 10.0 110.614 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.294 -0.86 . . . . 10.0 110.689 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.3 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.935 0.398 . . . . 10.0 110.512 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -77.7 135.55 38.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.406 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 94.4 t -120.67 118.84 57.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.991 0.424 . . . . 10.0 110.563 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -106.19 112.01 24.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.057 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.37 158.8 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.82 0.343 . . . . 10.0 111.179 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 34.9 mtm -127.0 107.28 9.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.636 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 mm -78.43 106.33 8.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -101.75 101.52 12.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.259 0.552 . . . . 10.0 112.487 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.6 ttp85 -91.72 72.56 5.81 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.377 -1.342 . . . . 10.0 107.377 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 67.6 -80.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.075 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttt -116.02 -5.46 11.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.97 0.414 . . . . 10.0 111.132 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.0 m -96.58 94.6 7.44 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 2.9 m -95.86 112.31 24.07 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.939 0.4 . . . . 10.0 110.851 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 44.8 mt -106.37 116.8 50.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.988 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -77.15 116.83 18.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -112.1 112.29 23.8 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.335 0.588 . . . . 10.0 111.854 -178.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -100.76 103.48 14.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.432 -1.321 . . . . 10.0 107.432 178.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.13 -164.39 1.28 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.314 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -125.4 153.55 43.24 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.23 -27.35 61.95 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.169 0.433 . . . . 10.0 112.169 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -8.6 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 16.4 m -84.4 147.61 27.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.622 0.249 . . . . 10.0 110.704 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 8.2 p -92.42 163.47 13.84 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.313 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 83.5 t -64.0 -36.71 77.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.591 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.17 -32.51 71.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.3 -31.59 71.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.066 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.26 -42.38 99.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.507 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 94.9 mttt -62.95 -37.35 86.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.061 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -61.84 -43.22 99.29 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.968 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.09 -48.93 81.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.093 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.6 t -61.14 -36.45 72.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.758 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.66 -35.02 75.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.148 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.72 -18.52 72.81 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.574 -0.822 . . . . 10.0 112.276 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.3 mt -92.21 -53.46 8.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.749 0.309 . . . . 10.0 111.226 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.4 mt -84.08 -13.28 53.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 mttt 63.01 32.58 15.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.675 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -121.0 138.83 28.3 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.24 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -50.33 135.08 39.07 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.314 2.676 . . . . 10.0 112.895 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -74.02 -16.1 23.04 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.037 2.491 . . . . 10.0 112.521 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.78 -35.99 79.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.027 -0.533 . . . . 10.0 112.028 -178.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -101.49 16.99 23.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -92.29 124.42 36.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.1 mmt-85 -112.24 114.05 26.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.438 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -98.21 113.35 25.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.333 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -112.21 122.59 48.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.696 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -124.99 130.29 52.06 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.17 35.83 18.31 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.472 0.482 . . . . 10.0 110.488 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 68.94 12.43 8.62 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.212 -0.904 . . . . 10.0 112.908 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -129.12 157.29 42.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.884 0.373 . . . . 10.0 111.496 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.35 143.35 33.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.405 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 93.6 mt -93.05 156.68 16.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.243 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.2 t0 -92.98 119.88 32.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.788 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.507 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 9.7 m-20 -57.57 -31.89 66.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.056 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.01 -3.74 90.64 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.611 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -101.1 153.72 19.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.47 . . . . 10.0 111.59 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 28.8 p -88.4 167.97 13.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.197 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 67.8 mt -60.49 -42.83 97.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 10.0 110.74 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.44 -41.52 98.62 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.622 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.24 -29.29 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.312 . . . . 10.0 111.686 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.7 m -79.85 -5.73 56.03 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.93 10.03 41.11 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.584 -0.817 . . . . 10.0 113.312 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -79.96 67.39 5.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.179 0.514 . . . . 10.0 110.828 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.51 155.16 23.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.053 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -26.32 63.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.0 0.428 . . . . 10.0 111.728 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.11 -26.51 64.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.399 . . . . 10.0 110.917 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.69 -51.91 4.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.616 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.45 95.86 10.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.502 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -109.8 156.14 40.33 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.084 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.26 -14.36 37.55 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.306 2.004 . . . . 10.0 110.407 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.44 -7.4 21.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.995 -1.002 . . . . 10.0 109.956 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -160.87 88.61 1.69 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.363 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -74.25 147.74 37.91 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.732 2.288 . . . . 10.0 111.58 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.86 110.27 10.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.999 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.59 119.37 14.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.715 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 41.4 t -115.7 134.83 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.72 126.61 7.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.479 -0.867 . . . . 10.0 112.169 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 23.6 tp -111.12 105.6 14.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.908 0.385 . . . . 10.0 111.049 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.64 124.72 50.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.651 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -95.77 119.0 33.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.797 0.332 . . . . 10.0 110.116 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 18.9 ttp180 -79.66 78.8 6.2 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.923 -0.581 . . . . 10.0 111.099 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -98.52 129.65 45.09 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.692 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -68.18 150.08 48.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.988 -0.551 . . . . 10.0 109.768 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 70.11 7.62 6.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.561 0.538 . . . . 10.0 110.832 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 7.0 m -123.12 132.89 54.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.141 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -100.46 -4.26 29.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.43 . . . . 10.0 111.011 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.05 -24.63 67.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.686 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.98 74.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.871 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.65 -14.38 60.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.807 0.336 . . . . 10.0 111.666 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 51.2 m -84.18 -28.31 27.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.134 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 22.6 mt -94.51 -25.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.531 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -69.41 112.63 12.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.67 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -72.0 -10.95 26.84 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.262 2.642 . . . . 10.0 111.416 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -74.85 -33.17 62.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.243 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -102.51 -40.17 6.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.549 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -119.43 142.63 32.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.535 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.38 152.97 80.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.765 2.31 . . . . 10.0 111.99 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.43 126.35 22.18 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.084 2.522 . . . . 10.0 112.193 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -66.14 112.71 4.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.787 -0.642 . . . . 10.0 111.77 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 32.2 tp -139.34 120.57 9.77 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.498 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.84 128.59 31.08 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.069 2.513 . . . . 10.0 112.076 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -59.62 -31.78 69.81 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.949 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 19.3 m -71.03 -17.55 20.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.19 0.519 . . . . 10.0 111.338 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 81.0 mmm -122.56 58.29 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -135.02 -54.48 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.492 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -75.55 60.36 5.81 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.612 2.208 . . . . 10.0 112.218 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -123.44 -156.68 0.72 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.157 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -113.15 172.53 6.89 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.923 -0.311 . . . . 10.0 110.443 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 15.9 m -99.97 136.28 40.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.058 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.34 -144.99 9.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.563 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -35.95 11.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.925 0.393 . . . . 10.0 110.655 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 49.9 m -80.59 158.37 25.75 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.382 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.65 123.71 20.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.908 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 73.17 5.6 5.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.761 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -71.6 131.5 43.3 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -110.36 138.93 46.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.077 0.465 . . . . 10.0 111.529 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -108.88 111.21 22.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.807 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -81.17 123.94 38.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.754 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.176 179.702 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.147 0.498 . . . . 10.0 110.798 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -108.88 122.83 48.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.91 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 25.1 mt -101.32 120.46 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.534 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.65 115.81 48.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.112 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -87.13 173.69 9.09 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.919 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.9 m -68.17 -21.19 64.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.244 0.545 . . . . 10.0 110.704 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.81 -8.4 56.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.685 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.41 12.09 73.71 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.573 -0.822 . . . . 10.0 111.461 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.04 134.46 35.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -103.56 106.93 17.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.265 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -98.31 109.99 22.65 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.714 0.292 . . . . 10.0 111.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 14.6 mm -94.38 112.81 27.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.39 133.74 42.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.718 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -59.3 128.64 38.12 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -53.88 -35.19 61.3 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.239 0.337 . . . . 10.0 111.674 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -56.74 -40.28 75.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.145 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -86.32 -33.33 20.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.066 0.46 . . . . 10.0 110.084 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.86 -40.04 93.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.344 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.34 -47.18 86.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.309 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.32 -40.06 93.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.691 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -65.29 -36.72 84.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.167 0.508 . . . . 10.0 109.824 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.27 -6.58 86.46 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.268 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -79.12 -27.33 42.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -83.38 143.32 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -66.49 95.42 0.32 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.471 . . . . 10.0 111.317 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.85 -171.3 2.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.144 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 91.8 mmm -79.59 31.81 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.847 0.356 . . . . 10.0 111.952 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 16.3 tp -66.17 -39.23 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.316 0.579 . . . . 10.0 110.016 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.51 7.04 24.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.593 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.95 -64.72 3.71 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.655 -0.702 . . . . 10.0 112.583 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.99 173.4 8.39 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.473 2.116 . . . . 10.0 111.666 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.96 -63.64 5.14 Favored Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.968 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -140.04 125.02 18.5 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.892 0.377 . . . . 10.0 110.134 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -88.25 110.16 20.51 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.287 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.5 152.82 28.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.218 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.33 -33.93 75.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.231 0.539 . . . . 10.0 109.737 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.58 -35.78 78.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.34 -0.846 . . . . 10.0 109.545 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -77.36 -22.84 51.12 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.452 -0.795 . . . . 10.0 110.023 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -73.86 -34.31 64.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.19 0.519 . . . . 10.0 109.739 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -70.73 -47.26 60.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.756 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -133.0 97.22 3.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.743 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.5 t -83.11 125.77 40.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.07 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -94.14 111.34 23.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.935 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -102.08 110.7 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.399 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -101.06 144.9 29.42 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.799 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 69.71 22.7 6.02 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.86 0.725 . . . . 10.0 110.491 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 76.6 mt -131.51 107.21 14.43 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.335 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -64.72 156.64 60.38 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 123.069 2.513 . . . . 10.0 112.249 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.6 p -69.12 -34.89 75.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.577 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -35.77 76.47 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.688 0.625 . . . . 10.0 112.688 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 32.9 m -87.37 -31.37 5.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.401 -0.52 . . . . 10.0 111.209 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.68 -33.89 75.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.277 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -40.59 98.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.823 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -64.49 -37.97 89.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.249 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.83 -46.25 94.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.83 -43.19 98.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.852 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.16 -38.78 91.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.874 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -64.6 -42.88 95.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.525 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -62.37 -44.86 95.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.541 . . . . 10.0 109.912 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 29.1 m -60.0 -43.3 95.28 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.992 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -63.65 -42.17 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.173 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 12.6 tptt -64.3 -37.27 86.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.131 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.28 -50.31 80.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -70.78 -31.27 67.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.442 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -62.52 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.091 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -75.7 -15.94 60.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.966 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.04 -55.77 4.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.945 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.5 p -145.95 -34.31 0.31 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.693 0.627 . . . . 10.0 112.693 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 9.8 m -78.4 44.4 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.106 0.479 . . . . 10.0 112.216 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -18.35 26.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.552 0.691 . . . . 10.0 109.796 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -89.1 8.46 29.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.513 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 pt -111.21 163.92 16.2 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.14 149.9 82.34 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.466 2.111 . . . . 10.0 112.676 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -70.66 165.45 22.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.32 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -45.31 128.66 5.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.285 0.365 . . . . 10.0 111.151 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.76 5.4 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.077 2.518 . . . . 10.0 112.482 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 7.2 pt -79.54 57.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.5 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.8 -55.22 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.483 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -58.47 107.59 0.34 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.987 1.791 . . . . 10.0 112.187 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -72.61 57.02 0.4 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.761 -0.654 . . . . 10.0 112.6 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mm -125.24 -4.35 5.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.348 0.594 . . . . 10.0 109.919 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.7 68.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.783 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 29.8 tp -67.1 -29.9 69.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.379 0.609 . . . . 10.0 109.425 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 -64.23 -34.74 78.8 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.459 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -76.47 -27.82 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.265 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 94.6 mt -73.06 -15.69 61.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.776 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 51.9 ttp -61.91 -26.12 67.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.695 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.69 83.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.76 -58.21 0.44 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.902 0.751 . . . . 10.0 112.59 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -82.65 50.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.516 0.674 . . . . 10.0 110.337 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.87 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.76 -0.136 . . . . 10.0 112.76 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -68.63 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.69 0.626 . . . . 10.0 112.69 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.3 -21.67 66.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -51.73 -31.96 28.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.335 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -115.49 -35.0 4.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.007 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -63.0 -36.07 82.34 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.546 0.573 . . . . 10.0 112.546 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.54 72.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.682 0.277 . . . . 10.0 111.257 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.1 tp -68.31 -32.04 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.162 0.506 . . . . 10.0 110.667 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.07 -18.1 50.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.741 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 -11.68 29.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.055 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.7 tp -165.21 113.56 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.221 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.8 mt -90.14 78.72 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -107.37 102.55 44.58 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.643 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -91.99 53.1 0.69 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.946 2.431 . . . . 10.0 111.697 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -100.63 -177.15 3.4 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.918 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -86.77 152.7 22.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.767 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.8 mm -120.49 105.92 17.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.679 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.442 ' HZ1' ' C ' ' A' ' 37' ' ' TRP . 4.4 tttp -120.2 146.23 42.03 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -32.87 133.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 124.227 3.285 . . . . 10.0 113.5 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -62.24 155.27 57.73 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 123.216 2.611 . . . . 10.0 113.401 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 122.96 63.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.477 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.78 -16.11 51.27 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.457 2.771 . . . . 10.0 112.893 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -42.26 98.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 10.0 110.121 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 t -120.99 -113.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.709 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -171.9 57.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.062 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.3 tttm -152.8 151.92 31.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.134 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.8 pp -72.0 156.28 39.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.683 0.277 . . . . 10.0 110.977 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -96.43 161.82 13.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.475 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -101.69 124.95 48.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.657 -0.498 . . . . 10.0 109.657 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -174.91 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.109 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.7 -64.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.516 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.442 ' C ' ' HZ1' ' A' ' 23' ' ' LYS . 2.0 m0 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.141 -0.933 . . . . 10.0 109.281 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmm . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 120.831 0.348 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -177.93 104.1 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.657 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 55.5 t -119.56 123.66 71.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.282 0.563 . . . . 10.0 111.78 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.01 116.67 31.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.237 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.65 151.33 48.2 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.182 0.515 . . . . 10.0 112.326 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 41.7 mtm -122.3 104.58 9.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.137 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.7 mm -81.75 104.24 10.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.58 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -101.54 104.31 15.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.0 ttp85 -91.93 69.79 5.48 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 66.98 -79.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.343 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -110.03 -11.29 14.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.643 0.259 . . . . 10.0 111.345 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 102.93 12.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.646 -0.252 . . . . 10.0 110.887 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 17.8 m -101.72 124.29 47.12 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.872 0.368 . . . . 10.0 110.914 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 53.1 mt -116.41 122.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.987 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -84.66 122.65 29.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.851 0.358 . . . . 10.0 110.144 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -117.96 130.17 56.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.491 . . . . 10.0 111.634 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -110.74 103.89 12.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.97 -168.65 2.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.453 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -129.49 161.22 30.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -54.26 -28.13 39.56 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.5 m -68.08 -25.43 65.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.4 m -73.24 137.4 44.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.619 0.247 . . . . 10.0 110.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -87.98 167.28 13.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.875 0.369 . . . . 10.0 111.181 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.1 -35.53 75.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.19 -34.96 77.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.172 0.51 . . . . 10.0 110.517 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.38 -31.17 71.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.847 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 mt -66.32 -43.98 84.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 10.0 109.949 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.439 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 87.1 mttt -61.07 -34.66 75.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.43 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -67.96 -32.96 73.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.447 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -69.5 -46.69 75.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -63.48 -35.07 71.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -60.53 -38.03 83.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.291 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.15 1.05 71.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.729 -0.748 . . . . 10.0 112.946 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.56 -56.05 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.891 0.377 . . . . 10.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.75 -13.72 44.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.503 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.9 mttt 61.7 31.64 18.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.728 -0.669 . . . . 10.0 112.166 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -105.04 142.86 25.53 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.654 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.16 125.22 17.48 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.893 2.395 . . . . 10.0 112.496 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -64.11 -21.36 67.91 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.953 2.435 . . . . 10.0 112.322 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.31 -29.75 70.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -96.11 -4.07 43.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.78 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.9 135.19 35.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.935 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -127.14 110.21 12.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.115 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.81 111.66 23.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.904 0.383 . . . . 10.0 110.661 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -107.44 109.95 21.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.758 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -118.52 134.01 55.42 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 62.35 32.0 17.1 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.253 0.549 . . . . 10.0 109.715 -178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 67.93 10.54 7.87 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.021 -0.991 . . . . 10.0 112.066 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -124.59 151.37 44.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.017 0.437 . . . . 10.0 111.303 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.8 tp -74.83 126.44 30.95 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.185 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.48 153.54 41.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.899 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -93.1 112.34 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.961 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.439 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 1.7 m-20 -60.31 -27.24 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.137 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.66 -12.79 83.25 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.942 -0.647 . . . . 10.0 112.714 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -102.27 161.49 13.66 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.876 0.369 . . . . 10.0 111.038 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.6 p -90.97 172.9 8.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.885 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.39 -29.61 70.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.525 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.49 -43.96 98.63 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.131 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -75.08 -15.21 60.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.76 0.282 . . . . 10.0 111.76 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 53.5 m -95.84 15.35 20.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.825 0.345 . . . . 10.0 111.782 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.37 41.56 96.46 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.017 -0.611 . . . . 10.0 113.115 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -101.97 48.62 0.87 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.002 0.43 . . . . 10.0 110.228 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.01 149.79 49.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.512 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -22.69 65.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.977 0.418 . . . . 10.0 111.717 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.2 mm-40 -72.81 -32.03 65.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.066 0.46 . . . . 10.0 110.418 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.81 -37.97 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.797 179.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.5 92.14 3.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.508 -0.769 . . . . 10.0 109.138 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -106.74 163.5 16.85 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.23 -16.27 53.97 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.334 2.023 . . . . 10.0 111.2 178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.34 1.28 23.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.613 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.8 82.84 1.79 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.577 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -74.88 143.43 29.48 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.923 2.416 . . . . 10.0 111.987 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.77 118.05 13.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.805 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.76 123.26 26.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.44 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 34.9 t -122.99 136.32 60.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.26 134.38 12.4 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.73 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.47 102.76 10.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.897 0.38 . . . . 10.0 111.838 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.43 130.74 38.02 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -111.59 116.48 30.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.629 0.252 . . . . 10.0 110.998 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -70.99 104.25 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.179 0.514 . . . . 10.0 111.005 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.01 126.97 49.72 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.804 -0.634 . . . . 10.0 109.367 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -66.29 133.27 50.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.953 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 76.26 -22.38 0.28 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.265 0.839 . . . . 10.0 113.265 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.4 m -85.25 106.39 16.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.994 0.426 . . . . 10.0 110.429 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -77.51 -4.36 45.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.163 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -60.07 -30.95 69.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.916 0.388 . . . . 10.0 110.897 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.54 -34.2 66.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.964 -0.562 . . . . 10.0 112.471 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.76 -30.04 69.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.4 m -79.6 -12.35 59.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.701 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 mt -100.29 -0.85 10.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 10.0 111.098 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -97.81 110.89 57.36 Favored Pre-proline 0 C--N 1.323 -0.553 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.009 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -70.73 2.49 4.02 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.257 2.638 . . . . 10.0 112.383 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -94.1 -18.67 21.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.213 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.4 p -118.94 -42.11 2.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.165 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.3 m -106.52 153.33 40.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.991 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.04 159.09 23.91 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.382 2.055 . . . . 10.0 111.366 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.66 126.23 20.01 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.585 2.19 . . . . 10.0 111.591 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -70.99 103.81 2.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.505 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.6 tp -131.38 126.54 21.33 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.447 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.67 134.07 60.4 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.819 2.346 . . . . 10.0 111.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.01 -37.64 88.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.272 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.6 m -73.51 -15.95 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.324 0.583 . . . . 10.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 89.7 mmm -112.78 39.14 2.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.508 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -115.76 -53.74 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.169 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -73.11 69.77 3.85 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 122.314 2.01 . . . . 10.0 111.553 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -137.1 170.68 15.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -85.63 175.54 8.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.785 0.326 . . . . 10.0 110.794 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.3 m -96.63 143.65 27.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.348 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.18 -153.21 29.67 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.213 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -33.73 13.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.212 0.529 . . . . 10.0 110.877 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.8 m -89.09 163.41 15.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.879 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.61 132.13 45.72 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.041 -0.725 . . . . 10.0 109.041 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.85 -0.28 3.41 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.709 0.63 . . . . 10.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -76.49 131.61 39.11 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -115.48 151.33 34.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.053 0.454 . . . . 10.0 111.365 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -118.21 106.02 12.38 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.046 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.52 127.86 32.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.809 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.412 179.652 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.134 0.492 . . . . 10.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -105.42 121.93 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.586 -0.734 . . . . 10.0 110.847 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 39.1 mt -95.7 115.06 26.88 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mt -98.7 109.78 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.5 p -83.33 170.82 14.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.73 0.3 . . . . 10.0 110.975 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.1 m -67.84 -19.8 65.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.886 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -82.91 -4.87 58.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.079 0.466 . . . . 10.0 110.296 179.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.22 65.57 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.406 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.96 130.49 34.53 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -95.17 117.16 29.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.238 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.25 106.47 16.65 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.686 0.279 . . . . 10.0 110.882 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 mm -94.34 116.54 35.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.63 136.17 43.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.591 0.234 . . . . 10.0 110.88 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -58.62 129.37 41.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -57.94 -25.53 61.04 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 112.683 0.623 . . . . 10.0 112.683 -178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -55.17 -49.81 70.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.198 0.523 . . . . 10.0 110.149 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -77.95 -32.14 51.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.864 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -37.22 86.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.342 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 64.8 mt -59.98 -52.4 65.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.978 0.418 . . . . 10.0 110.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 1.7 m -62.1 -44.21 97.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.973 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.6 m -62.1 -38.78 90.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.996 0.427 . . . . 10.0 110.848 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.29 -10.11 78.16 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.066 -0.588 . . . . 10.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 23.6 m -86.5 -25.17 25.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.249 0.547 . . . . 10.0 109.582 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 mt -75.1 170.61 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.883 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -73.29 78.33 1.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 10.0 110.681 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.14 9.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.796 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.31 45.18 0.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.712 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tt -70.24 -37.5 74.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.045 0.45 . . . . 10.0 110.233 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.73 12.91 13.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.841 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.3 -60.97 6.13 Favored Glycine 0 CA--C 1.523 0.537 0 CA-C-N 115.789 -0.641 . . . . 10.0 113.027 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -67.91 -178.31 1.61 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.621 2.214 . . . . 10.0 112.253 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.3 -49.08 68.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.891 -0.671 . . . . 10.0 112.158 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -149.69 133.38 16.81 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.23 100.8 12.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.032 0.444 . . . . 10.0 110.352 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.48 159.13 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.042 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.3 -28.59 63.19 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -61.83 -42.54 99.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.046 0.45 . . . . 10.0 110.083 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -72.8 -20.29 61.18 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -79.78 -32.0 40.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.209 0.528 . . . . 10.0 109.621 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -75.04 -51.05 14.51 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -131.55 106.63 8.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.76 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.3 t -92.82 115.07 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.535 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -90.15 113.75 25.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.979 0.419 . . . . 10.0 111.176 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -102.26 103.13 13.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.89 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -92.35 148.44 22.13 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 69.1 17.57 8.45 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.808 0.693 . . . . 10.0 110.716 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.84 108.17 16.91 Favored Pre-proline 0 C--O 1.237 0.425 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.793 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.33 149.39 91.36 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.069 2.512 . . . . 10.0 112.504 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 6.4 p -62.77 -40.07 96.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.576 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.72 -53.15 58.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 10.0 112.257 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.21 -34.47 66.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.904 -0.319 . . . . 10.0 111.217 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.17 -30.8 71.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.946 0.403 . . . . 10.0 110.332 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -62.97 -40.57 98.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.499 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -68.1 -35.13 77.66 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.284 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.18 -46.32 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.619 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.31 -41.59 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.902 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 63.3 mtm -65.66 -40.76 92.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.914 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.28 -42.22 96.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.603 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -62.94 -44.5 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.278 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 43.4 m -58.88 -43.09 90.86 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.488 0.661 . . . . 10.0 109.794 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.59 -43.43 84.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.117 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . 0.426 ' HZ3' ' CD ' ' C' ' 74' ' ' GLU . 1.9 tpmt? -61.42 -39.68 91.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.362 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.43 -45.03 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.416 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -77.31 -38.83 49.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.72 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.21 -52.39 63.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.491 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.7 50.59 1.92 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.599 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -158.56 -54.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.438 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -139.77 -38.08 0.48 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.279 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 40.18 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.917 0.389 . . . . 10.0 111.769 -179.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.7 -8.03 56.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.291 0.567 . . . . 10.0 110.244 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -79.72 -27.71 40.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.149 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 27.5 pt -92.22 165.3 20.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.842 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -73.68 -178.33 3.68 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.329 2.019 . . . . 10.0 113.422 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . 0.426 ' CD ' ' HZ3' ' C' ' 62' ' ' LYS . 12.4 tp10 -78.58 173.37 12.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.32 -0.854 . . . . 10.0 108.907 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.31 129.77 51.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 123.104 0.252 . . . . 10.0 110.445 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.3 123.02 10.35 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.121 2.548 . . . . 10.0 112.534 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 23.0 pt -82.09 38.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.494 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.57 -57.03 0.24 Allowed Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 10.0 112.081 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.78 103.48 0.71 Allowed 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.119 1.879 . . . . 10.0 111.189 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -76.71 51.93 0.79 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.708 0.633 . . . . 10.0 112.708 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 27.8 mm -118.34 -9.18 11.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.479 0.657 . . . . 10.0 110.096 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.3 -29.31 66.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.255 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 11.6 tp -73.25 -26.14 60.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.181 0.515 . . . . 10.0 110.165 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.7 -27.36 69.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.715 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.85 -23.87 52.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.897 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 53.1 tp -72.53 -12.63 61.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.516 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 48.3 ttp -62.53 -29.13 70.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.983 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.54 78.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.687 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.81 -51.36 0.68 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.934 0.716 . . . . 10.0 112.934 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -83.76 34.32 0.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.221 0.534 . . . . 10.0 110.773 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 4.1 t80 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 179.975 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 112.102 -0.399 . . . . 10.0 112.102 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -61.37 2.23 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.52 0.563 . . . . 10.0 112.52 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.5 tp -63.6 -30.65 71.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.348 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -56.7 -26.29 56.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.926 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -106.79 -38.64 6.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.443 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.6 -39.87 85.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.942 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.06 -38.44 72.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.328 . . . . 10.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.38 -34.25 76.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.102 0.477 . . . . 10.0 110.785 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.9 0.74 46.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.924 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.47 -48.06 3.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.162 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -140.08 110.02 6.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.89 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.8 mt -76.17 114.89 16.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.702 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -126.6 92.03 45.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.873 0.368 . . . . 10.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -83.26 48.52 2.71 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.952 2.434 . . . . 10.0 111.979 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -93.15 -170.03 2.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.03 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -96.55 168.4 10.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.02 0.438 . . . . 10.0 111.612 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.0 mm -111.97 151.04 14.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.173 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.28 138.88 0.58 Allowed Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 179.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.4 137.74 1.46 Allowed 'Trans proline' 0 C--O 1.239 0.566 0 C-N-CA 123.354 2.702 . . . . 10.0 113.058 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.57 136.0 64.4 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.044 2.496 . . . . 10.0 112.059 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.18 123.65 88.05 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.643 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.0 -7.65 20.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.001 2.467 . . . . 10.0 112.466 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -36.6 78.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 10.0 111.034 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -132.88 -113.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.724 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -162.16 56.14 0.24 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.211 0.529 . . . . 10.0 110.912 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.7 tttm -151.57 155.19 37.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pp -84.55 151.69 24.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.705 -0.479 . . . . 10.0 109.705 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.97 175.92 7.9 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.633 -0.258 . . . . 10.0 110.386 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.47 119.53 29.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.652 0.263 . . . . 10.0 110.845 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.93 -70.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.269 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.408 ' C ' ' HE ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 175.37 -56.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.454 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.421 ' H1 ' ' CD ' ' B' ' 20' ' ' GLU . 9.0 tmm? . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.831 0.348 . . . . 10.0 110.708 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.25 141.91 30.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.826 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 76.4 t -128.8 126.78 65.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.128 0.489 . . . . 10.0 110.826 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -116.39 118.04 31.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.888 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.37 160.75 34.14 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.692 0.282 . . . . 10.0 111.13 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 58.1 mtm -127.83 108.63 10.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.863 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.9 mm -82.26 102.71 8.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -100.51 105.18 16.6 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.534 0.568 . . . . 10.0 112.534 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -94.14 82.67 4.17 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.959 -1.497 . . . . 10.0 106.959 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 66.79 -86.15 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.204 -177.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -119.65 6.88 11.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.151 0.5 . . . . 10.0 111.102 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.7 m -105.86 95.19 5.62 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 6.4 m -95.09 117.13 29.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.016 0.436 . . . . 10.0 110.943 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 52.8 mt -108.17 117.23 53.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.555 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -74.04 116.68 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -107.7 114.22 28.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.234 0.54 . . . . 10.0 111.511 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -103.49 110.6 22.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -141.14 -159.78 1.0 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.979 0.419 . . . . 10.0 111.937 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -129.86 161.27 31.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.344 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . 0.421 ' CD ' ' H1 ' ' B' ' 1' ' ' MET . 14.1 mt-10 -61.56 -24.49 66.68 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.663 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -16.61 59.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.303 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 19.2 m -76.04 144.03 41.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.501 0.191 . . . . 10.0 111.015 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 37.9 p -90.15 168.17 12.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.829 0.347 . . . . 10.0 111.042 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 79.4 t -67.42 -35.59 73.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.852 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.57 -32.81 74.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.1 0.476 . . . . 10.0 110.515 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.71 -34.08 77.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.417 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 69.9 mt -63.38 -44.65 94.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.447 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 94.3 mttt -62.1 -35.06 77.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.529 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -66.76 -34.38 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.222 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 85.8 mt -71.18 -45.55 70.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.55 -36.26 72.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.085 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -59.89 -39.82 86.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.66 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.64 -10.17 84.77 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.67 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.5 mt -103.04 -51.75 8.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 111.755 0.28 . . . . 10.0 111.755 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 58.5 mt -89.15 -13.06 39.28 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 57.83 43.5 21.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.399 0.618 . . . . 10.0 112.021 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -127.22 140.68 38.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.259 -0.882 . . . . 10.0 110.033 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -48.99 119.98 4.97 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.403 2.735 . . . . 10.0 112.986 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.72 -16.87 42.43 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.113 2.542 . . . . 10.0 112.258 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.71 -32.78 74.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.567 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -100.74 11.29 39.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.823 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -90.58 126.99 36.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -110.98 123.31 49.93 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.3 121.49 45.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.622 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -119.97 129.84 54.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.814 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 43.2 tttm -130.0 129.45 43.75 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 64.93 25.98 12.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.011 0.434 . . . . 10.0 110.287 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 71.98 19.06 4.8 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.27 -0.877 . . . . 10.0 111.235 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -125.94 152.96 44.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.281 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -78.1 137.35 38.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.378 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 92.8 mt -85.98 165.22 16.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.191 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -112.07 121.18 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.684 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.447 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 44.7 m-20 -61.83 -28.99 69.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.203 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.98 -5.17 86.39 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.552 -0.832 . . . . 10.0 113.431 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -104.66 157.51 17.13 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.112 0.456 . . . . 10.0 111.433 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.0 p -89.25 165.14 14.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.613 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 45.8 mt -59.04 -42.48 90.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.313 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.35 -31.62 66.6 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.046 -0.597 . . . . 10.0 112.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -79.73 -23.73 42.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.028 0.442 . . . . 10.0 110.914 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 52.0 m -86.66 0.8 53.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.6 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.77 8.88 57.92 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.977 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -80.6 98.51 7.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.888 0.375 . . . . 10.0 110.125 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.89 164.41 23.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.7 m -67.86 -10.94 57.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 10.0 112.048 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -77.93 -37.58 47.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.126 0.489 . . . . 10.0 110.066 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -48.08 6.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.852 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -94.26 96.47 9.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.784 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.34 161.14 24.02 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.547 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.41 -15.86 51.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.478 2.119 . . . . 10.0 111.481 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.75 2.14 23.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.987 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -163.84 85.91 1.25 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.576 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.29 147.6 42.27 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.739 2.293 . . . . 10.0 111.334 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.97 116.23 11.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.02 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.74 117.13 11.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.443 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.01 133.68 62.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.67 128.7 9.24 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.657 -0.782 . . . . 10.0 112.409 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.11 114.35 26.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 10.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.95 124.61 53.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.657 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -100.5 113.58 26.48 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -77.32 112.74 14.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.963 0.411 . . . . 10.0 111.54 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.54 147.83 52.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.524 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -71.46 139.62 49.71 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.07 -0.344 . . . . 10.0 110.07 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 t70 77.92 -31.0 0.16 Allowed 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.603 0.564 . . . . 10.0 112.224 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.9 m -83.3 95.11 8.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 10.0 111.059 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -74.23 -4.01 33.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.202 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -56.26 -32.44 64.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.663 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.07 76.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.209 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.2 mt -72.68 -18.76 61.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.978 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.15 -11.46 38.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.405 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 53.4 mt -101.44 -31.59 3.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.431 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.03 114.15 15.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.484 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -74.0 -0.65 9.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.1 2.533 . . . . 10.0 111.354 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.66 -16.09 37.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.987 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.24 -42.88 2.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.859 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 10.5 m -113.23 150.49 43.1 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.83 154.95 66.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.593 2.195 . . . . 10.0 111.553 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.73 130.6 37.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.882 2.388 . . . . 10.0 112.496 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.97 102.22 1.95 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.909 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.7 tp -140.27 130.0 13.55 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.833 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.41 131.77 47.75 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.992 2.461 . . . . 10.0 111.803 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -65.6 -34.42 78.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -68.97 -20.36 24.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.286 0.565 . . . . 10.0 110.532 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 65.4 mmm -107.6 54.97 0.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.65 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . 0.465 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 32.9 mtpt -133.62 -47.71 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.97 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . 0.465 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 64.6 Cg_endo -72.95 45.23 0.88 Allowed 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.166 1.911 . . . . 10.0 113.493 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 -119.38 175.0 6.03 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.649 -0.501 . . . . 10.0 109.649 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -90.49 165.86 13.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.637 0.256 . . . . 10.0 110.379 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 50.7 m -89.99 143.85 26.42 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.211 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.96 -150.75 11.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.259 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.26 -27.93 15.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.36 0.6 . . . . 10.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.68 165.72 12.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.273 -0.876 . . . . 10.0 110.871 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.79 138.18 46.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.612 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 68.52 4.79 4.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.823 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -86.07 128.93 34.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -114.67 141.68 47.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.941 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.21 101.17 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -74.04 133.97 30.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.787 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.994 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.893 0.378 . . . . 10.0 110.923 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -108.84 113.8 27.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.961 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 mt -91.29 127.83 36.88 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -113.14 120.61 63.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.489 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -94.31 166.52 12.04 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.126 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -1.24 11.83 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.198 0.444 . . . . 10.0 112.198 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -95.06 2.96 55.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.851 0.357 . . . . 10.0 110.216 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.06 33.54 57.0 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.78 -0.724 . . . . 10.0 111.433 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -108.65 128.4 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -97.02 121.67 39.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.896 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -112.35 110.03 20.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.601 0.239 . . . . 10.0 110.585 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 21.6 mm -96.06 116.03 36.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.9 t -104.72 135.9 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.406 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -58.97 131.89 52.39 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -57.89 -34.86 70.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 10.0 112.013 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -56.78 -38.11 72.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.693 0.282 . . . . 10.0 111.411 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -82.96 -32.67 26.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.141 0.496 . . . . 10.0 110.083 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.82 -29.72 70.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.89 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.29 -55.9 28.96 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.417 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.8 -40.1 96.32 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.283 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.0 m -62.2 -35.34 78.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.469 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.44 -18.18 79.95 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.092 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 14.0 m -79.76 -28.57 40.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.089 0.471 . . . . 10.0 109.765 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mt -74.53 149.76 7.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.158 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.61 113.47 6.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 10.0 110.414 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -134.06 177.57 7.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.871 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.4 mmm -78.87 38.06 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.894 0.378 . . . . 10.0 111.581 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.64 -37.73 85.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.23 0.538 . . . . 10.0 110.019 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.5 m -91.56 18.58 7.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.314 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.53 -60.55 5.74 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.671 -0.695 . . . . 10.0 112.834 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.84 172.02 7.71 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.356 2.038 . . . . 10.0 112.311 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.23 -55.18 27.74 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 115.885 -0.598 . . . . 10.0 113.167 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -149.67 110.48 4.3 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.505 -0.409 . . . . 10.0 111.11 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -77.27 90.6 3.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.087 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.4 171.83 14.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.137 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.07 -33.59 69.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.329 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -60.85 -44.13 97.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.156 0.503 . . . . 10.0 109.85 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -72.6 -26.21 61.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.685 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 10.4 m -74.07 -35.41 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.248 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -76.48 -50.92 12.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.109 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -124.8 107.32 10.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.302 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 t -92.89 103.66 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.972 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -90.14 119.48 30.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.977 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -98.81 142.29 30.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.214 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -112.58 135.72 52.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.405 -0.362 . . . . 10.0 111.609 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 64.92 19.48 11.86 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.47 -0.786 . . . . 10.0 112.197 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.0 mt -114.74 107.46 50.57 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.396 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -59.71 149.52 82.39 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 123.191 2.594 . . . . 10.0 112.377 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -65.01 -35.86 82.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.758 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -56.16 24.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.953 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -67.62 -33.3 61.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.354 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.63 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -59.66 -38.04 80.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -67.11 -32.6 73.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.355 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.84 -46.76 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -59.84 -41.45 91.39 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.702 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 59.7 mtm -68.51 -39.32 81.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.787 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -63.07 -44.84 94.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.718 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.27 -44.99 95.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.397 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 57.8 m -58.73 -41.98 87.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.865 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.43 -47.41 76.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.914 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -59.04 -40.93 86.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.866 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 42.2 t -57.96 -50.23 78.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.625 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -72.07 -38.82 69.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.949 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -58.03 -42.37 85.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.47 19.94 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.005 0.431 . . . . 10.0 111.513 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -128.4 -44.66 1.38 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.803 0.335 . . . . 10.0 111.543 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.98 -38.67 0.27 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.956 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.68 41.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.868 0.322 . . . . 10.0 111.868 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.66 -18.96 33.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.329 0.585 . . . . 10.0 110.247 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -73.0 -14.62 61.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.952 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 17.1 pt -101.03 160.45 26.64 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -73.93 175.27 11.05 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.318 2.012 . . . . 10.0 113.015 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.41 172.52 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.485 -0.78 . . . . 10.0 109.508 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -49.66 126.36 17.82 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 122.457 0.303 . . . . 10.0 110.528 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.28 122.77 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.295 2.664 . . . . 10.0 113.029 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 5.7 pt -76.58 59.77 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.752 -0.658 . . . . 10.0 112.341 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.96 -59.12 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.56 106.84 2.04 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.159 1.906 . . . . 10.0 111.682 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -73.46 50.69 0.32 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.049 -0.523 . . . . 10.0 112.372 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -110.17 19.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.71 0.767 . . . . 10.0 109.862 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.5 -42.43 18.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.062 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.35 -30.17 70.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.208 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -59.7 -41.67 91.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.998 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 87.3 mt -78.77 -38.04 39.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.705 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -61.44 -32.37 72.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.357 -0.838 . . . . 10.0 110.846 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 33.0 ttp -59.6 -19.85 51.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.989 -0.55 . . . . 10.0 112.083 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.46 -32.49 71.44 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.54 -58.89 0.42 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 124.021 0.826 . . . . 10.0 113.223 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -82.04 39.45 0.57 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.164 0.507 . . . . 10.0 111.025 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.492 -0.243 . . . . 10.0 112.492 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -66.18 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 -179.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.98 -27.26 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.499 -178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -55.34 -29.7 58.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.601 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -102.25 -40.43 6.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.96 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.4 mt -57.66 -36.11 71.44 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.498 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.48 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.72 0.295 . . . . 10.0 110.586 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.48 -31.22 70.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.383 0.611 . . . . 10.0 110.127 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.46 -18.18 61.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.819 . . . . 10.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.57 -53.21 4.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.24 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.89 132.62 21.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 111.593 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.2 mt -88.97 114.46 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -116.38 100.47 53.48 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.401 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -89.41 32.9 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.121 2.548 . . . . 10.0 111.826 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -92.23 170.4 9.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.004 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -83.23 160.51 21.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.906 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.6 mm -108.98 153.78 10.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.441 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -167.18 133.76 1.85 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -39.21 127.64 1.44 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.612 2.874 . . . . 10.0 113.031 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.89 127.5 24.59 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 123.349 2.699 . . . . 10.0 112.297 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.14 132.12 91.94 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.519 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.94 -20.58 45.38 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 123.445 2.763 . . . . 10.0 113.745 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -34.13 77.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.782 0.325 . . . . 10.0 111.244 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.1 m -128.37 -160.8 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.696 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -129.99 51.52 2.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 10.0 110.815 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -149.7 148.0 28.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.602 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.01 154.27 41.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.909 0.385 . . . . 10.0 111.148 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.03 162.42 14.38 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.756 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.2 tt0 -112.02 115.45 28.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.254 -0.276 . . . . 10.0 110.254 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -156.87 -76.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.865 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.18 -59.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.3 m0 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.359 -0.829 . . . . 10.0 109.857 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmm . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.59 0.233 . . . . 10.0 111.506 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.63 142.14 28.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 95.6 t -127.8 125.66 65.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.775 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -113.77 112.35 23.28 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.615 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.57 158.04 41.08 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.785 0.326 . . . . 10.0 111.06 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 31.7 mtm -126.24 112.81 16.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.734 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mm -84.32 105.69 13.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -100.85 102.35 13.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 32.3 ttp85 -92.38 65.33 4.51 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.036 -1.468 . . . . 10.0 107.036 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 65.11 -86.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.022 -0.99 . . . . 10.0 111.479 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -95.24 -21.65 18.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.665 0.246 . . . . 10.0 111.665 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -99.58 105.18 17.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.665 0.269 . . . . 10.0 111.684 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 26.4 m -103.18 121.39 42.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.716 0.293 . . . . 10.0 110.236 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 64.3 mt -111.08 117.95 56.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.434 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -77.39 113.09 14.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -106.26 108.27 19.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.325 0.583 . . . . 10.0 111.928 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -95.46 106.45 18.52 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.684 -1.228 . . . . 10.0 107.684 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -129.28 -165.85 1.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.548 -0.296 . . . . 10.0 111.286 -178.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -125.32 160.65 28.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.28 -21.87 66.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.91 0.386 . . . . 10.0 111.953 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -16.98 57.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.389 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.6 m -72.99 147.0 45.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.887 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 38.9 p -96.79 166.13 11.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.922 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.58 -35.17 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.184 0.516 . . . . 10.0 109.705 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -60.58 -37.55 81.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.994 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -65.07 -34.63 78.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.958 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.93 -45.37 92.83 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.806 -0.442 . . . . 10.0 109.806 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.442 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 96.0 mttt -64.28 -34.03 77.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.539 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -67.26 -33.29 75.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.148 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -72.14 -46.29 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 88.0 t -64.2 -31.64 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.234 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.36 -43.11 78.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.973 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.26 -19.71 79.45 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 10.0 112.515 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 75.2 mt -87.69 -59.75 2.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 111.845 0.313 . . . . 10.0 111.845 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.6 mt -80.83 -12.67 59.39 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.086 0.402 . . . . 10.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 84.9 mttt 60.17 36.35 21.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.155 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 27.3 mtt180 -127.65 144.82 52.5 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.731 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.52 127.68 16.49 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.699 2.933 . . . . 10.0 113.856 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.39 -19.76 28.44 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.886 2.391 . . . . 10.0 111.81 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.66 -28.85 68.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.691 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -94.28 0.23 55.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.32 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -84.93 129.03 34.87 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.241 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 64.9 mmt-85 -116.7 107.11 14.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.189 -0.459 . . . . 10.0 109.862 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.4 mt -89.63 113.73 25.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.554 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -110.8 113.59 26.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.125 0.488 . . . . 10.0 111.813 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -119.01 128.91 54.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 62.93 37.78 11.71 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.488 0.493 . . . . 10.0 110.947 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 64.36 21.43 12.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.218 -0.901 . . . . 10.0 112.027 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -136.73 155.65 49.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.8 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.7 tp -78.13 141.13 38.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.466 -0.333 . . . . 10.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 mt -84.89 151.82 24.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.076 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -88.72 118.57 28.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.281 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.442 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 5.0 m-20 -62.15 -26.99 68.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 10.0 112.267 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.37 2.69 81.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.074 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -109.81 154.97 22.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.231 0.539 . . . . 10.0 111.731 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 36.5 p -86.79 172.21 10.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.501 -0.772 . . . . 10.0 109.59 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.2 mt -63.71 -37.63 88.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.701 0.286 . . . . 10.0 110.399 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.83 -33.74 87.83 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.893 -0.67 . . . . 10.0 112.182 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.57 -25.82 45.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.697 0.284 . . . . 10.0 111.525 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.9 m -89.41 0.96 56.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.18 64.31 1.66 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.714 -0.755 . . . . 10.0 113.096 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -124.7 47.37 2.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.857 0.36 . . . . 10.0 110.175 179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 79.1 p -68.34 164.02 21.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -17.39 63.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.765 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.84 -30.17 50.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.09 0.471 . . . . 10.0 110.239 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.94 -36.27 12.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.075 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -108.45 100.22 9.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 109.875 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.04 157.0 44.55 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.21 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.87 -14.79 46.26 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.372 2.048 . . . . 10.0 111.33 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.78 0.86 24.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.622 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . 0.438 ' CB ' ' H ' ' B' ' 112' ' ' ALA . . . -164.51 90.29 1.04 Allowed Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.126 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -76.76 138.07 18.55 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.956 2.437 . . . . 10.0 111.449 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.96 122.88 16.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.666 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.03 122.6 25.16 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.569 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 45.3 t -125.6 129.24 72.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.37 140.85 19.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.785 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -119.86 105.46 11.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.049 0.452 . . . . 10.0 111.885 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.8 127.96 44.88 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -104.04 117.73 34.98 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.954 -0.298 . . . . 10.0 111.187 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -71.98 97.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.684 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.67 126.53 47.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.188 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.26 134.47 57.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.876 -0.602 . . . . 10.0 112.084 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 67.8 7.58 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.432 -0.804 . . . . 10.0 112.542 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 4.2 m -105.56 98.71 8.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.165 0.507 . . . . 10.0 110.325 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -66.92 -14.23 62.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.098 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -57.12 -32.17 66.07 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.998 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.48 67.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.79 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.7 mt -83.12 -5.25 59.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.521 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 27.2 m -105.28 -14.84 15.22 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.3 mt -104.23 6.29 10.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.155 0.502 . . . . 10.0 111.164 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -104.52 107.24 57.36 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.173 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.58 -10.66 27.22 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.049 2.5 . . . . 10.0 111.955 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -76.81 -20.68 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.912 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -119.14 -48.42 2.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.954 -0.567 . . . . 10.0 111.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 20.0 m -115.13 141.47 27.07 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.965 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.44 153.74 75.8 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.526 2.151 . . . . 10.0 111.929 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.19 141.46 94.44 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.046 2.497 . . . . 10.0 112.633 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -72.71 117.61 14.63 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.187 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 31.6 tp -146.32 124.23 6.18 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.486 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -66.64 136.27 41.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.751 2.301 . . . . 10.0 112.13 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -66.83 -30.91 71.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.397 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.7 m -70.91 -16.04 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.496 0.665 . . . . 10.0 110.243 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 88.1 mmm -124.27 54.49 1.35 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.318 -0.856 . . . . 10.0 108.99 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . 0.437 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 39.9 tttm -132.23 -49.5 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.329 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . 0.437 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 10.3 Cg_exo -73.02 65.57 4.15 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 122.309 2.006 . . . . 10.0 111.958 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -134.72 174.97 9.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.902 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -90.87 176.96 6.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.845 0.355 . . . . 10.0 111.201 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -102.93 135.62 44.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.123 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -88.82 -143.64 9.58 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.046 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.84 -38.47 11.22 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.185 0.516 . . . . 10.0 110.722 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.3 m -76.75 159.61 30.0 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.761 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . 0.438 ' H ' ' CB ' ' B' ' 71' ' ' ALA . . . -67.16 121.14 14.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 179.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 72.33 16.92 4.97 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.915 0.759 . . . . 10.0 111.903 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -71.53 119.98 16.45 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.822 0.344 . . . . 10.0 110.078 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.88 122.48 33.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.834 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.9 103.28 12.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.883 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 t -90.46 101.38 12.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.52 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -179.254 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.78 0.324 . . . . 10.0 111.363 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -110.87 117.59 33.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.707 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 31.7 mt -92.61 123.56 36.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.081 -0.509 . . . . 10.0 109.839 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 mt -107.57 116.98 52.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.8 p -89.04 177.76 6.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.494 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 13.7 m -76.99 2.85 13.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.862 0.363 . . . . 10.0 111.658 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -102.14 3.67 38.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 10.0 110.356 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.56 12.83 84.13 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.649 -0.786 . . . . 10.0 111.398 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.6 133.94 33.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.657 0.265 . . . . 10.0 110.324 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -107.18 126.66 52.68 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.071 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.66 108.57 16.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.562 -0.29 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -89.79 118.68 35.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.841 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 23.6 t -105.95 135.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -59.71 132.04 52.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 110.135 -0.321 . . . . 10.0 110.135 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -52.06 -37.04 52.39 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.447 0.467 . . . . 10.0 111.21 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.53 -43.22 71.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.537 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -85.27 -33.36 22.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.035 0.445 . . . . 10.0 110.742 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.47 91.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.521 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.39 -48.18 81.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.966 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -39.54 93.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.468 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -64.88 -36.7 85.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.8 -6.7 82.48 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.657 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 19.8 m -91.02 -22.1 20.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.307 0.575 . . . . 10.0 109.71 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -76.6 152.44 5.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.651 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -70.62 80.53 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.175 0.512 . . . . 10.0 110.529 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -97.36 178.15 5.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.853 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 94.3 mmm -78.5 35.39 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.981 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.57 -26.54 66.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.353 0.597 . . . . 10.0 109.606 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 4.3 m -95.54 17.65 14.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.243 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.85 -61.99 3.8 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.573 -0.739 . . . . 10.0 112.673 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.33 -174.8 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.514 2.143 . . . . 10.0 111.901 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.04 -79.21 0.15 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.986 -0.626 . . . . 10.0 112.519 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -122.24 127.71 50.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -88.65 85.17 6.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.317 0.579 . . . . 10.0 111.076 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.11 155.39 32.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.34 -25.43 49.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.996 0.739 . . . . 10.0 112.996 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.11 -39.45 90.02 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.616 -0.512 . . . . 10.0 109.616 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -88.84 -13.98 38.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.267 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 6.8 m -78.27 -40.26 37.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 10.0 110.191 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -75.66 -44.43 42.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.179 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -128.63 103.62 7.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.321 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.9 t -94.8 123.64 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.885 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -101.35 121.03 41.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.877 0.37 . . . . 10.0 110.892 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -101.61 117.31 34.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.956 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 -92.16 132.79 36.35 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.374 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 75.11 3.81 4.15 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.998 0.811 . . . . 10.0 112.279 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 72.1 mt -106.62 109.02 62.85 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.984 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.57 157.68 59.5 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.152 2.568 . . . . 10.0 112.127 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.9 p -64.78 -39.36 93.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.498 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -52.24 -59.07 4.83 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.818 0.673 . . . . 10.0 112.818 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.93 -35.66 75.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 10.0 111.397 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 -33.97 77.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.804 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 26.1 m -61.92 -43.06 99.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.893 0.378 . . . . 10.0 110.547 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -66.43 -35.6 80.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.311 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.36 -47.55 91.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.09 179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 36.0 m -60.29 -42.92 96.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.854 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.3 mtm -67.26 -37.27 83.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -65.74 -41.95 91.56 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.427 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -64.72 -45.7 85.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.104 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 42.9 m -58.69 -42.35 88.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.301 0.572 . . . . 10.0 109.665 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -64.75 -43.7 92.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.143 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -62.79 -40.75 98.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.098 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.07 -50.48 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -68.89 -37.85 79.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.338 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -58.2 -48.24 80.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.064 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.13 7.05 23.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.67 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.85 -46.93 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.177 -0.327 . . . . 10.0 111.57 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 6.3 m -146.15 -34.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 4.9 m -80.74 42.5 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.296 0.48 . . . . 10.0 112.296 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.06 -7.13 57.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.241 0.543 . . . . 10.0 110.066 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -78.76 -21.54 47.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 pt -95.96 163.8 20.17 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.194 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -76.99 -177.31 3.72 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.304 2.003 . . . . 10.0 112.726 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.96 169.9 13.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.009 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -54.16 128.98 58.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.556 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -50.76 129.49 27.5 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.126 2.551 . . . . 10.0 112.834 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 pt -81.65 36.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.08 -59.71 0.53 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.395 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -79.74 119.67 4.09 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.764 1.643 . . . . 10.0 110.505 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.35 12.32 1.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 38.4 mm -78.9 75.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.408 0.623 . . . . 10.0 109.952 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -138.92 -43.21 0.47 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.119 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 13.4 tp -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.644 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 23.9 mp0 -60.5 -37.29 80.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.325 -0.852 . . . . 10.0 109.47 178.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -79.49 -36.64 38.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.731 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.77 -31.75 73.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.525 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.9 ttp -58.98 -25.2 63.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.915 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.15 -35.49 73.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.05 -55.2 0.56 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.293 0.849 . . . . 10.0 113.293 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -81.97 36.17 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.117 0.484 . . . . 10.0 111.14 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.695 -0.669 . . . . 10.0 109.574 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.195 -0.362 . . . . 10.0 112.195 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -57.82 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.5 tp -63.12 -27.85 69.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.933 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -55.51 -35.09 65.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.265 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -95.36 -37.33 11.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.329 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.07 -36.85 84.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.385 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.8 88.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.349 . . . . 10.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.3 tp -68.6 -30.03 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.279 0.561 . . . . 10.0 109.547 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.43 -8.89 59.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.52 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.15 -35.69 11.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.171 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 tp -163.56 122.38 2.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.172 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.0 mt -82.55 92.65 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -104.45 107.21 57.16 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.44 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -95.29 52.62 0.2 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.325 2.684 . . . . 10.0 111.173 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -108.87 174.82 5.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.874 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -80.47 143.02 33.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.739 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -100.24 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.074 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.88 136.24 25.38 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -34.5 133.49 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.147 3.231 . . . . 10.0 113.624 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -62.98 138.23 66.78 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.0 2.467 . . . . 10.0 112.442 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.48 125.76 91.76 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.376 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -61.13 -22.33 74.35 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.224 2.616 . . . . 10.0 113.198 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -35.89 82.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.051 0.453 . . . . 10.0 111.074 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 t -120.07 -132.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.86 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -158.98 52.66 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.112 0.482 . . . . 10.0 111.258 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -149.57 148.44 29.36 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -72.65 148.9 44.35 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.83 0.347 . . . . 10.0 110.681 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.4 172.93 8.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.075 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -117.16 113.59 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.399 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -156.57 -81.64 0.07 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 -62.62 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.9 m0 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.54 179.654 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 mmm . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.949 0.404 . . . . 10.0 110.801 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.77 122.95 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.922 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.3 t -123.65 116.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.107 0.48 . . . . 10.0 111.095 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -105.08 110.97 23.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.551 -0.75 . . . . 10.0 109.473 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.56 154.63 40.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.991 0.425 . . . . 10.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 53.9 mtm -122.77 104.87 9.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.334 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.4 mm -78.2 107.25 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.912 -0.773 . . . . 10.0 108.912 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -109.95 104.4 13.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.866 0.691 . . . . 10.0 112.866 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 27.8 ttp85 -89.03 67.43 8.1 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.595 -1.261 . . . . 10.0 107.595 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 67.77 -76.69 0.05 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.174 -0.921 . . . . 10.0 111.485 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -110.01 -9.35 14.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.483 -0.326 . . . . 10.0 111.382 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -105.2 99.59 9.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.062 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.2 m -101.17 125.53 47.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.923 0.392 . . . . 10.0 111.019 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 40.2 mt -121.52 121.85 65.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.313 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -79.6 121.69 25.58 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -114.7 119.82 38.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.089 0.471 . . . . 10.0 111.452 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -103.31 103.68 13.72 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.207 -1.034 . . . . 10.0 108.207 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.64 -166.66 1.72 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.653 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -128.88 165.5 20.92 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.754 -0.462 . . . . 10.0 109.754 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -61.52 -28.46 69.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.649 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 m -69.13 -21.49 64.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.85 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 2.3 m -73.75 145.23 45.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.743 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 31.5 p -94.34 162.97 13.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.761 0.315 . . . . 10.0 111.033 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.89 -34.03 67.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.133 0.492 . . . . 10.0 109.992 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -62.56 -34.99 78.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.406 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -68.24 -33.37 74.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.906 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.15 -43.71 98.24 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.459 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 99.1 mttt -62.23 -33.81 75.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.237 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtp180 -66.2 -40.44 90.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.512 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.61 -46.8 91.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.835 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.98 -36.84 77.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.673 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -56.5 -43.39 79.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.34 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.88 -18.02 78.74 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -94.08 -57.29 4.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.774 0.321 . . . . 10.0 111.528 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 22.1 mt -76.87 -14.19 59.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.3 mttt 64.75 31.61 11.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.373 0.606 . . . . 10.0 110.994 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -123.42 135.08 25.67 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.856 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -53.07 138.82 62.61 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 123.384 2.723 . . . . 10.0 113.028 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.82 -12.53 31.03 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.831 2.354 . . . . 10.0 111.19 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.15 -45.66 75.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.204 -0.907 . . . . 10.0 112.134 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -99.83 16.76 22.68 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -88.04 123.45 32.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.816 0.341 . . . . 10.0 110.849 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -116.1 111.86 20.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.11 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -96.01 120.39 36.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.402 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -113.75 127.8 56.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.0 tttm -135.49 137.26 41.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 62.44 25.26 15.06 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.347 0.405 . . . . 10.0 110.379 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 75.18 4.32 4.16 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.404 -0.816 . . . . 10.0 112.239 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -119.54 163.11 17.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.069 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.0 tp -79.97 141.14 36.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.544 0.211 . . . . 10.0 110.689 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -80.37 155.58 27.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.318 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -98.92 115.37 28.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.859 0.361 . . . . 10.0 111.199 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.459 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 78.4 m-20 -60.33 -29.37 68.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.639 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 3.84 75.88 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.003 -0.617 . . . . 10.0 113.485 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -118.02 163.53 16.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.066 0.46 . . . . 10.0 111.017 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.5 p -92.25 170.44 9.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.896 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.26 -41.91 98.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.904 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.73 -40.58 95.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.09 -0.576 . . . . 10.0 112.512 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -72.27 -21.16 61.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 10.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 70.2 m -89.47 3.17 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.009 0.433 . . . . 10.0 111.646 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.61 2.72 63.1 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.724 -0.751 . . . . 10.0 113.293 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -75.77 96.85 3.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.05 0.425 . . . . 10.0 110.171 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 55.1 p -114.94 164.55 13.98 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 20.0 m -72.52 -2.45 19.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.304 0.573 . . . . 10.0 110.476 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -90.17 -49.42 6.57 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.642 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -35.02 55.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.043 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.11 103.69 12.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -119.31 163.07 28.81 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.731 -178.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -66.78 -14.88 45.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.043 1.829 . . . . 10.0 110.531 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.76 -1.62 27.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.169 -0.923 . . . . 10.0 110.104 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -163.63 84.17 1.35 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.438 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.87 136.41 16.68 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.855 2.37 . . . . 10.0 111.837 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 122.19 17.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.418 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -80.81 124.69 29.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.948 0.404 . . . . 10.0 111.448 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.6 t -117.87 125.92 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.95 126.85 7.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.768 -0.73 . . . . 10.0 111.91 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.54 111.17 22.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.719 0.295 . . . . 10.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -107.29 128.91 54.87 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.669 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -105.04 116.58 32.19 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.229 -0.285 . . . . 10.0 110.229 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -76.75 85.5 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.581 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -96.72 131.42 43.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.77 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.79 140.22 58.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.28 7.4 4.87 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.982 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.8 m -117.87 104.59 11.08 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -76.68 0.36 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 10.0 112.061 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -57.12 -32.22 66.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.04 0.448 . . . . 10.0 110.657 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.23 -26.24 67.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.747 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.8 mt -75.66 -26.29 57.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.831 0.348 . . . . 10.0 111.005 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 22.4 m -83.61 -32.32 25.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 17.6 mt -81.78 -27.09 9.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.388 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -70.01 110.51 6.8 Favored Pre-proline 0 C--O 1.234 0.284 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.314 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.88 -8.89 24.74 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.544 2.829 . . . . 10.0 112.531 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.842 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.9 m -99.0 -44.68 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.236 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 13.0 m -107.48 144.35 29.05 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 159.84 47.42 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.595 2.197 . . . . 10.0 111.576 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.22 128.07 21.79 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.559 2.172 . . . . 10.0 111.473 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.76 106.84 3.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.101 0.476 . . . . 10.0 111.668 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 35.1 tp -129.78 120.71 19.65 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.188 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -51.43 120.31 6.73 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.755 2.303 . . . . 10.0 111.761 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.01 -33.7 71.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.427 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.14 -15.32 18.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.808 0.337 . . . . 10.0 111.347 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 67.5 mmm -115.22 21.28 14.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.412 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -96.41 -51.08 0.23 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 113.565 0.95 . . . . 10.0 113.565 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.62 82.87 1.12 Allowed 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.145 1.897 . . . . 10.0 112.743 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -161.03 -171.69 3.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.689 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -104.83 174.99 5.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.916 0.389 . . . . 10.0 111.215 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -100.99 157.12 16.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.49 -129.99 5.1 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.678 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 10.5 m -110.93 -31.09 7.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.093 0.473 . . . . 10.0 110.024 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 51.0 m -86.53 170.76 11.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.932 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.47 134.04 36.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.1 t30 70.59 7.38 6.19 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.555 0.535 . . . . 10.0 111.032 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -84.9 121.06 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -108.87 151.78 25.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.741 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -128.81 103.81 7.27 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.477 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.7 134.29 30.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 12.6 mp0 . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.183 179.764 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.061 0.457 . . . . 10.0 110.841 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -105.25 115.86 30.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.452 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.63 133.29 35.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.882 -0.784 . . . . 10.0 108.882 178.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 13.3 mt -118.6 113.63 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.762 -0.199 . . . . 10.0 110.691 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.15 161.33 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -20.98 64.78 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.256 0.465 . . . . 10.0 112.256 -179.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -74.15 -10.48 59.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.704 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.16 39.25 8.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.595 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -111.73 140.95 45.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.719 0.295 . . . . 10.0 110.265 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -99.86 128.64 45.94 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.495 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -127.69 96.73 4.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.95 0.405 . . . . 10.0 110.531 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.55 116.48 34.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.001 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.5 t -100.54 141.5 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.823 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -55.98 130.09 42.44 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.169 0.293 . . . . 10.0 110.237 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -54.6 -34.8 62.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.702 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -56.49 -46.85 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.154 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -74.65 -31.95 62.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.15 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.44 68.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.909 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 55.4 mt -58.75 -56.82 17.3 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.151 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -65.9 -31.39 72.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.716 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 43.9 m -65.32 -33.27 75.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 10.0 109.922 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.17 -12.82 82.8 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.128 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.09 -12.5 57.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.389 0.614 . . . . 10.0 110.029 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 45.5 mt -90.71 146.69 5.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.813 -0.81 . . . . 10.0 108.813 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.33 76.52 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.438 0.637 . . . . 10.0 111.102 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.55 -174.21 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.094 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 91.7 mmm -79.12 37.36 0.31 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mp -69.8 -32.64 71.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.16 13.96 19.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.17 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.97 -56.3 4.5 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.633 -0.712 . . . . 10.0 113.109 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -66.73 179.63 2.09 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.661 2.241 . . . . 10.0 112.434 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.28 -46.77 14.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.698 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -141.76 104.68 4.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.766 0.317 . . . . 10.0 110.606 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -87.02 89.61 8.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.98 0.419 . . . . 10.0 110.602 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.98 174.91 8.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.569 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.23 -25.85 68.25 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.673 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -58.98 -43.28 91.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.054 0.454 . . . . 10.0 109.779 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -75.34 -18.49 59.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.822 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.9 m -78.57 -30.32 46.75 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -81.68 -50.88 8.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.661 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.18 107.13 9.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -94.55 103.77 15.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.455 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -89.39 122.68 32.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.036 0.446 . . . . 10.0 111.053 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -103.62 144.03 31.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.632 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -113.65 132.52 55.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.507 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 61.02 28.94 18.68 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.694 0.621 . . . . 10.0 112.663 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 83.7 mt -121.82 103.08 40.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.587 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -57.5 140.28 92.77 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.092 2.528 . . . . 10.0 113.097 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -59.61 -36.1 75.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.278 -0.873 . . . . 10.0 111.093 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -51.22 70.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.43 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.1 m -70.85 -29.21 36.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.95 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 tp -66.37 -36.91 84.08 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -61.98 -33.94 75.24 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.139 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 13.4 tptp -65.42 -39.93 92.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.571 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -67.24 -46.52 83.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.933 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 76.5 m -58.21 -42.87 87.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.428 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.2 mtm -64.9 -39.52 93.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.815 0.34 . . . . 10.0 110.884 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -67.48 -39.06 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.379 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -64.22 -46.5 83.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.06 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 31.5 m -59.19 -42.1 90.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.374 0.607 . . . . 10.0 109.782 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -66.56 -43.48 84.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.39 179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -63.62 -38.77 92.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.492 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.35 -47.44 92.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.986 0.422 . . . . 10.0 110.253 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.867 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -58.21 -45.08 88.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.639 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -87.31 21.54 2.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.202 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -131.4 -47.82 0.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.085 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.22 -39.87 0.4 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.011 0.375 . . . . 10.0 112.011 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.53 39.67 0.21 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.04 -11.03 45.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.126 0.488 . . . . 10.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -92.57 4.82 52.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.42 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 pt -118.25 156.38 50.76 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.186 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.69 159.72 16.43 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.2 2.6 . . . . 10.0 112.999 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -69.09 171.08 8.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.215 -0.902 . . . . 10.0 109.597 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -47.91 130.76 11.76 Favored Pre-proline 0 C--O 1.233 0.19 0 O-C-N 123.291 0.369 . . . . 10.0 110.923 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -53.09 111.8 0.76 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.078 2.519 . . . . 10.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 15.1 pt -76.75 61.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.371 0.605 . . . . 10.0 111.18 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -114.67 -53.3 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.11 119.72 6.85 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.948 1.765 . . . . 10.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.78 -14.58 46.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.404 0.52 . . . . 10.0 112.404 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -79.62 98.67 3.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.046 0.451 . . . . 10.0 110.471 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.08 -43.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.648 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.18 -24.28 65.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 32.9 mp0 -62.88 -29.65 70.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.985 -1.007 . . . . 10.0 109.779 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.01 -32.45 57.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.452 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -21.41 63.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.984 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.0 ttp -66.1 -18.74 65.54 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.663 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.95 -33.18 75.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.776 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.72 -61.28 0.37 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.985 0.803 . . . . 10.0 112.933 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -82.65 45.95 1.03 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.903 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.097 -0.705 . . . . 10.0 109.097 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 112.145 -0.382 . . . . 10.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -55.9 18.39 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.37 -30.47 69.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -58.12 -32.68 68.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 10.0 111.042 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -96.95 -40.8 8.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.001 0.429 . . . . 10.0 110.426 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.27 -42.7 95.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.16 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.23 64.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.727 0.298 . . . . 10.0 111.082 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.2 tp -63.83 -40.06 95.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.023 0.44 . . . . 10.0 110.422 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -14.15 59.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.955 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.9 -24.16 20.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -164.54 110.37 1.0 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 10.0 111.835 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.2 mt -84.31 88.02 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -96.1 106.65 29.83 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.836 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -88.23 60.32 3.02 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.546 2.831 . . . . 10.0 112.092 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -126.91 167.28 16.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -79.32 151.97 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.24 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.2 mm -113.47 100.02 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.456 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.6 tttp -107.63 138.26 19.94 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.41 133.12 0.16 Allowed 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.756 2.97 . . . . 10.0 113.422 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -53.42 151.85 22.26 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.898 3.065 . . . . 10.0 114.281 -178.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mp -81.07 122.36 81.59 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.641 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -59.19 -26.21 80.91 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.274 2.649 . . . . 10.0 113.091 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -35.96 78.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.62 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -118.59 -145.53 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -143.29 53.8 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.381 0.61 . . . . 10.0 110.634 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -150.38 150.28 31.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.026 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 pp -76.04 156.12 34.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 10.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.05 152.11 21.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.668 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -107.35 106.16 16.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.861 0.362 . . . . 10.0 110.509 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -164.36 -72.58 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.114 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.28 -69.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.143 -0.932 . . . . 10.0 109.4 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.855 0.359 . . . . 10.0 110.508 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.12 136.15 39.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.824 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.97 124.46 67.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.165 0.507 . . . . 10.0 110.93 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -113.74 111.7 22.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.735 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.32 156.15 40.88 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.962 0.411 . . . . 10.0 111.66 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 67.3 mtm -124.2 107.77 11.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.313 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.1 mm -80.56 109.45 15.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -105.74 105.89 16.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.162 0.431 . . . . 10.0 112.162 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 10.0 ttp85 -104.6 95.42 5.9 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 66.13 -88.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.622 0.577 . . . . 10.0 109.691 -178.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -129.16 11.4 5.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.321 0.581 . . . . 10.0 110.434 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -106.45 99.08 8.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.293 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 30.9 m -100.68 126.29 47.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.903 0.382 . . . . 10.0 111.083 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 64.7 mt -114.66 119.64 62.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.581 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -76.91 117.42 18.5 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.311 -0.625 . . . . 10.0 109.311 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.5 m -112.23 109.82 19.72 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.815 0.672 . . . . 10.0 112.815 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.05 106.87 19.29 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.322 -1.362 . . . . 10.0 107.322 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.31 -168.86 2.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.905 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -124.89 161.02 27.48 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.67 -27.1 66.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 10.0 111.74 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.56 -17.79 63.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.695 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.9 m -78.39 134.7 37.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.878 0.371 . . . . 10.0 110.781 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 20.1 p -85.13 167.26 15.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.197 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.39 -35.82 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 10.0 110.761 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -65.33 -33.34 75.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.638 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -65.74 -30.03 70.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.83 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 64.0 mt -66.8 -42.78 85.39 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -62.23 -31.57 72.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.212 -0.904 . . . . 10.0 110.526 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -64.59 -41.3 96.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.769 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.69 -43.4 93.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.96 -35.52 73.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.154 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.97 -41.11 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.02 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.93 -20.88 79.71 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.04 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.9 mt -93.77 -49.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 23.8 mt -84.58 -14.84 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.334 0.494 . . . . 10.0 112.334 -178.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 63.74 32.02 13.92 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.12 0.486 . . . . 10.0 111.696 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -126.35 146.27 55.72 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.866 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.71 133.01 55.28 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.418 2.745 . . . . 10.0 113.554 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -70.3 -17.35 35.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.539 2.826 . . . . 10.0 112.165 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -65.51 -31.57 72.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.572 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -90.94 -1.72 57.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -89.28 126.34 35.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.37 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -116.41 113.63 23.13 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 48.4 mt -92.31 114.76 27.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.859 0.361 . . . . 10.0 111.18 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -110.65 115.75 30.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.795 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -129.09 135.96 49.6 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.259 -1.015 . . . . 10.0 108.259 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 65.61 32.67 9.06 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.48 0.488 . . . . 10.0 110.627 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.73 13.9 9.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.523 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -135.01 165.9 24.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.729 0.299 . . . . 10.0 110.73 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 tp -82.58 140.43 33.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.583 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -87.87 146.25 25.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.554 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -88.43 113.76 24.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.64 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -56.96 -29.68 63.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.125 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -76.49 -6.2 83.8 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.592 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -108.77 161.47 15.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.006 0.403 . . . . 10.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 25.8 p -87.4 169.4 12.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.5 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.4 -43.5 96.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.189 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -55.27 -45.32 83.33 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.132 -0.556 . . . . 10.0 112.741 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -66.08 -28.93 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.111 0.412 . . . . 10.0 112.111 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 56.4 m -83.79 11.14 7.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 10.0 112.101 -179.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.87 49.12 7.27 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.763 -0.732 . . . . 10.0 112.777 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -118.48 57.18 0.86 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.169 0.509 . . . . 10.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 14.3 p -76.71 161.6 28.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.728 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.2 p -64.55 -20.04 65.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.489 . . . . 10.0 111.952 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -78.32 -26.98 47.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.778 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -46.04 9.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.065 0.46 . . . . 10.0 109.869 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -104.1 105.49 15.68 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.54 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -116.39 161.13 33.15 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.222 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.58 -19.07 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.219 1.946 . . . . 10.0 110.602 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.57 6.35 34.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.023 -0.989 . . . . 10.0 110.471 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -167.52 85.6 0.78 Allowed Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.925 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.93 147.63 24.29 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.916 2.411 . . . . 10.0 111.669 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.76 117.79 22.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.09 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 130.39 39.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.031 0.443 . . . . 10.0 111.622 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.36 132.41 71.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.05 129.37 9.03 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.846 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.3 tp -110.35 102.14 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.981 0.42 . . . . 10.0 111.962 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.12 132.61 37.1 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.372 -0.973 . . . . 10.0 108.372 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -117.07 119.1 34.22 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.848 -0.341 . . . . 10.0 111.398 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -70.76 117.52 12.38 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.997 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -131.23 149.96 52.35 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.395 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -76.58 126.13 30.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.665 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.87 -35.95 0.32 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.77 0.669 . . . . 10.0 112.567 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 94.63 2.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.869 0.366 . . . . 10.0 110.199 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -79.24 16.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.909 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.33 -25.81 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.48 67.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.699 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.37 -41.62 98.77 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -79.19 -7.85 58.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 mt -106.25 -0.52 9.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.481 0.658 . . . . 10.0 110.035 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.84 106.71 45.59 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -65.83 -12.27 34.52 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.164 2.576 . . . . 10.0 112.146 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -76.6 -25.17 53.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.619 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -116.48 -32.77 5.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 2.0 m -125.03 146.97 55.36 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.483 0.183 . . . . 10.0 110.971 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.07 153.57 57.45 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 122.413 2.075 . . . . 10.0 111.539 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.61 133.67 40.69 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.715 2.276 . . . . 10.0 112.466 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.62 123.8 24.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.436 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 22.9 tp -147.25 128.76 7.31 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.408 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.64 124.14 15.56 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.702 2.268 . . . . 10.0 111.564 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.86 -28.68 69.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.29 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.0 m -68.96 -12.49 16.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.147 0.499 . . . . 10.0 110.811 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 81.4 mmm -120.89 22.34 11.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.773 -0.648 . . . . 10.0 109.734 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -91.48 -51.18 0.31 Allowed Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.5 68.41 6.16 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.349 2.032 . . . . 10.0 112.244 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -132.48 -177.71 4.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.37 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -96.81 169.46 9.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.515 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 135.02 37.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.74 -147.67 7.94 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.972 -0.632 . . . . 10.0 113.372 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -99.27 -26.88 14.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.934 0.397 . . . . 10.0 110.89 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 21.0 m -91.41 163.92 14.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.269 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.45 125.36 25.88 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.676 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.3 t30 70.0 16.01 7.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.508 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -81.3 135.35 35.7 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.98 138.4 52.2 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.098 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -116.54 116.31 27.38 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.7 t -77.86 143.45 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.151 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.731 179.712 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.983 0.421 . . . . 10.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -115.12 128.37 56.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.132 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 34.2 mt -96.37 125.11 40.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.842 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -102.02 117.41 47.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.637 0.256 . . . . 10.0 110.597 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -86.86 161.33 18.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.837 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.47 -24.67 67.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.316 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.31 8.66 8.6 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.694 0.283 . . . . 10.0 111.176 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.05 43.82 25.47 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 110.774 -0.93 . . . . 10.0 110.774 -179.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -113.53 141.48 47.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.264 . . . . 10.0 110.451 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -112.27 131.43 55.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.236 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -124.1 104.73 9.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.652 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 8.9 mm -87.16 115.08 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -101.13 129.39 52.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 110.092 -0.336 . . . . 10.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -59.47 128.33 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -50.74 -35.96 34.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.47 0.545 . . . . 10.0 112.47 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -50.45 -46.67 56.78 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.333 0.396 . . . . 10.0 111.735 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -85.83 -27.71 24.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.164 0.507 . . . . 10.0 110.717 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.26 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.157 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.5 -49.04 75.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 10.0 110.215 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -40.22 90.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.622 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 18.9 m -63.5 -35.34 80.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.081 0.467 . . . . 10.0 110.459 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.64 -5.0 85.87 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.068 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 10.1 m -89.22 -27.23 20.76 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.359 0.6 . . . . 10.0 109.81 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 12.6 mt -75.65 153.3 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.678 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.11 85.34 1.03 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.089 0.471 . . . . 10.0 110.433 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -97.32 177.45 5.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.066 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.9 mmm -80.71 35.31 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.151 0.426 . . . . 10.0 112.151 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mp -69.06 -28.74 66.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.246 0.546 . . . . 10.0 109.9 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.37 14.33 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.05 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -74.78 -58.99 3.88 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.749 -0.66 . . . . 10.0 112.84 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.95 166.16 14.84 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.556 2.17 . . . . 10.0 112.246 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -49.1 79.0 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.831 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -147.57 115.04 6.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.698 0.285 . . . . 10.0 110.564 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -85.03 91.46 8.09 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.867 -0.419 . . . . 10.0 109.867 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.6 166.69 23.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.575 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.13 -32.12 73.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.619 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -63.94 -38.28 90.49 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.24 -24.32 61.36 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.91 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -74.96 -30.38 61.19 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -84.32 -52.96 5.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.26 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -124.94 100.36 6.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.904 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -85.01 114.93 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.986 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -93.17 114.74 27.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.96 0.41 . . . . 10.0 111.117 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -93.68 151.93 19.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.881 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -125.05 130.44 52.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.829 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 69.74 8.54 6.77 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.815 -0.63 . . . . 10.0 112.083 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 61.4 mt -105.44 114.58 63.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.692 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -73.06 142.78 34.99 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.931 2.421 . . . . 10.0 111.708 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.7 p -60.9 -33.37 73.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.66 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -51.9 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.936 -0.574 . . . . 10.0 111.667 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.7 m -78.67 -27.65 14.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.721 0.296 . . . . 10.0 111.268 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 40.3 tp -65.79 -32.88 74.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.074 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 84.5 p -61.28 -39.3 89.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.637 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -65.93 -32.83 74.55 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.655 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.07 -47.64 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 10.9 m -62.93 -40.07 96.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.797 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 54.8 ttm -63.26 -45.74 90.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.252 -0.885 . . . . 10.0 110.431 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -63.52 -41.76 98.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.767 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -61.88 -45.07 95.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.379 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 51.4 m -59.98 -42.12 93.49 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.304 0.574 . . . . 10.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.51 -41.63 96.3 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.404 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 tptt -63.11 -39.27 94.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.18 -0.464 . . . . 10.0 111.042 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 71.1 t -59.2 -48.42 86.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.126 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -70.7 -41.01 72.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.157 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -57.61 -43.74 84.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.257 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 24.99 2.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.144 0.497 . . . . 10.0 111.267 -179.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -135.53 -58.52 0.78 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.627 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.39 -28.8 2.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.322 0.49 . . . . 10.0 112.322 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -86.93 32.93 0.66 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.37 5.48 20.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 10.0 111.048 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -103.69 -3.38 25.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.963 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 40.0 pt -111.36 167.23 9.37 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.118 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.74 170.86 18.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.39 2.06 . . . . 10.0 113.08 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -70.01 168.15 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.565 -0.743 . . . . 10.0 109.609 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -51.64 134.61 35.39 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 123.202 0.314 . . . . 10.0 110.647 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.7 121.52 8.12 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.067 2.511 . . . . 10.0 112.718 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 26.6 pt -84.25 44.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.799 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.64 -53.94 0.14 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 112.768 0.655 . . . . 10.0 112.768 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.96 112.71 2.56 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.087 1.858 . . . . 10.0 112.598 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.07 55.48 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.335 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 mm -120.36 -11.7 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 10.0 111.253 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.36 82.57 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.44 -30.73 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 10.0 110.282 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -62.33 -35.95 80.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.877 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.39 -31.58 58.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.845 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.71 -27.49 68.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.351 -0.841 . . . . 10.0 110.614 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 19.8 ttp -60.51 -19.18 56.14 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.904 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.94 -34.19 74.33 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.689 -0.232 . . . . 10.0 111.106 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.69 -57.64 0.5 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.208 0.818 . . . . 10.0 113.208 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -81.91 38.6 0.53 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.954 0.407 . . . . 10.0 111.657 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--O 1.244 0.806 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 179.229 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.578 -0.209 . . . . 10.0 112.578 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -59.22 4.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.743 0.646 . . . . 10.0 112.743 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 24.8 tp -62.04 -31.77 72.21 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.891 0.377 . . . . 10.0 110.836 -178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -56.34 -33.85 66.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.786 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -97.27 -40.36 8.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.891 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.61 -39.33 87.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.953 -0.567 . . . . 10.0 112.441 -179.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.43 -36.58 81.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 10.0 111.155 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 tp -69.89 -37.3 75.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.178 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.46 -22.03 61.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.352 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.54 -51.49 7.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.087 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -141.61 112.92 7.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.524 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.7 mt -80.63 93.53 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.22 -1.03 . . . . 10.0 108.22 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -106.19 94.15 9.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.678 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -87.19 88.98 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.995 2.463 . . . . 10.0 110.683 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -138.43 -176.79 4.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.992 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -89.11 158.94 17.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.192 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.3 mm -100.68 162.45 3.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.406 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -177.75 128.14 0.3 Allowed Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -39.44 138.07 0.84 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.739 2.959 . . . . 10.0 113.421 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.74 138.14 84.61 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.965 2.444 . . . . 10.0 112.211 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.53 121.74 85.22 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.456 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -62.38 -23.63 75.23 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.886 2.391 . . . . 10.0 112.248 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -35.38 77.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.247 0.546 . . . . 10.0 109.975 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -116.07 -132.78 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.355 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -160.75 52.69 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.327 0.584 . . . . 10.0 109.989 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -154.6 149.32 26.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.843 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.77 156.08 38.21 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.506 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -171.52 1.99 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.502 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -130.38 129.11 42.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -169.28 -63.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.073 0.463 . . . . 10.0 110.609 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.79 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-N 114.757 -1.11 . . . . 10.0 109.006 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tmm? . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.568 0.223 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.98 137.03 33.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.309 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 88.5 t -125.3 124.93 68.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.124 0.488 . . . . 10.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -111.54 112.84 24.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.142 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -131.43 163.01 28.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.798 0.333 . . . . 10.0 111.191 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 34.7 mtm -128.54 108.27 10.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.2 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 49.7 mm -81.62 98.99 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.44 -0.948 . . . . 10.0 108.44 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -98.58 103.54 15.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 113.016 0.747 . . . . 10.0 113.016 -178.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 27.5 ttp85 -89.27 72.09 8.16 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.102 -1.444 . . . . 10.0 107.102 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 67.87 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.058 -0.974 . . . . 10.0 110.139 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -107.94 -12.6 15.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.799 0.333 . . . . 10.0 111.108 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -95.65 91.75 6.27 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.094 -0.336 . . . . 10.0 110.094 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.2 m -94.57 120.24 34.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.005 0.431 . . . . 10.0 110.815 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.99 119.38 58.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.685 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -74.34 117.22 15.9 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.33 112.3 24.67 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.201 0.524 . . . . 10.0 111.813 -178.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -104.44 101.66 11.34 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.67 -167.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.871 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -123.48 161.7 24.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.47 -26.03 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.871 0.367 . . . . 10.0 111.63 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.82 -15.28 60.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.89 -0.596 . . . . 10.0 111.625 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 9.2 m -74.85 143.76 43.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.258 . . . . 10.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -94.94 165.9 12.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.822 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.99 -37.42 79.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.815 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -62.93 -35.1 78.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.451 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.94 -36.11 82.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.419 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.6 mt -62.01 -44.6 96.37 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.04 -40.31 93.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.963 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -64.86 -37.15 86.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.272 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.13 -47.02 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.9 t -64.46 -33.74 64.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.248 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -57.86 -40.02 79.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.629 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.53 -2.52 90.54 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.654 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.1 mt -106.8 -51.6 7.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.944 0.402 . . . . 10.0 111.281 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.58 -7.67 49.54 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.238 0.459 . . . . 10.0 112.238 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 62.39 29.48 17.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.932 0.396 . . . . 10.0 111.422 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -114.99 136.63 22.61 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.19 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.94 128.8 31.76 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.282 2.654 . . . . 10.0 112.684 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.57 -14.46 36.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.384 2.723 . . . . 10.0 111.812 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.78 -43.72 85.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -99.12 14.54 28.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.921 -0.581 . . . . 10.0 112.096 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -87.07 127.2 35.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.211 -0.45 . . . . 10.0 109.929 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 31.8 mmt-85 -115.34 115.2 26.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.29 115.09 27.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.224 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.16 111.6 22.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.06 0.457 . . . . 10.0 111.819 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -111.21 128.35 55.89 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.977 -1.12 . . . . 10.0 107.977 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 60.99 32.06 19.92 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.29 0.567 . . . . 10.0 109.776 -179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 68.34 17.45 9.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.148 -0.933 . . . . 10.0 111.791 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -125.31 149.99 47.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.071 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 28.8 tp -79.22 136.97 37.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.627 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 86.5 mt -86.26 174.86 8.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 10.0 111.736 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -110.57 125.48 53.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -62.26 -27.64 69.15 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -178.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.63 2.11 79.79 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.686 -0.768 . . . . 10.0 113.973 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -105.14 148.7 26.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.081 0.44 . . . . 10.0 111.282 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 34.7 p -83.85 166.85 17.58 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.882 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 mt -57.94 -41.53 82.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.406 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.82 93.74 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.795 -0.717 . . . . 10.0 111.81 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.87 -24.59 65.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.768 0.318 . . . . 10.0 111.157 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 84.8 m -84.53 5.04 29.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.927 0.394 . . . . 10.0 111.854 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.76 14.67 60.82 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.679 -0.772 . . . . 10.0 114.149 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -87.17 79.43 8.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 117.134 0.467 . . . . 10.0 110.748 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 73.3 p -97.64 167.67 10.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.51 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 10.0 111.281 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -77.08 -35.37 56.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.739 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -90.05 -32.73 16.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.042 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.09 98.87 8.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.272 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -114.73 155.26 46.45 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.297 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.48 -16.49 55.41 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.229 1.952 . . . . 10.0 111.342 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -106.2 -1.03 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.466 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -158.04 88.44 2.39 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.879 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -78.3 140.18 17.2 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.821 2.348 . . . . 10.0 111.18 179.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.25 114.55 6.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 10.0 111.459 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.75 114.05 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.497 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 51.4 t -116.42 133.54 62.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.05 135.42 13.69 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.2 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 36.8 tp -114.38 107.06 15.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.792 0.33 . . . . 10.0 111.351 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.69 145.17 28.77 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -125.13 114.75 19.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -77.88 99.78 6.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.13 0.49 . . . . 10.0 111.44 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.74 128.54 54.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.21 131.91 51.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.822 0.304 . . . . 10.0 111.822 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 9.5 t70 73.27 -0.3 3.42 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.62 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 10.9 m -104.28 100.28 10.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.12 0.486 . . . . 10.0 110.518 179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -67.78 -10.23 50.89 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.704 0.631 . . . . 10.0 112.704 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.17 -22.84 63.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.942 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.02 -29.85 68.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.043 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 65.3 mt -83.73 -32.42 25.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.76 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.1 m -66.19 -37.08 84.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.741 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 mt -92.3 11.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.889 0.376 . . . . 10.0 111.585 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.5 101.49 17.63 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.821 0.343 . . . . 10.0 110.652 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.84 -10.17 21.6 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.411 2.74 . . . . 10.0 112.8 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.01 -28.8 35.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.048 0.452 . . . . 10.0 110.999 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 11.8 m -113.84 -21.16 10.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.925 0.393 . . . . 10.0 111.596 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 8.8 m -126.57 149.25 67.47 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.376 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.89 162.42 41.98 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.634 2.223 . . . . 10.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.19 150.09 71.26 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.43 2.086 . . . . 10.0 111.652 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.55 84.41 3.93 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.291 0.567 . . . . 10.0 110.915 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 34.5 tp -108.49 122.46 40.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.24 130.31 23.73 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.754 2.302 . . . . 10.0 111.06 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -35.71 81.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.025 0.441 . . . . 10.0 111.145 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.07 -18.48 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.753 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 90.0 mmm -111.53 28.55 8.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.754 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.76 -51.04 0.25 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 112.807 0.669 . . . . 10.0 112.807 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -72.9 56.54 3.01 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 122.593 2.195 . . . . 10.0 112.403 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -132.29 127.91 36.64 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -73.98 146.77 43.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.859 0.361 . . . . 10.0 111.913 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.7 m -63.82 139.05 58.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.745 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.21 -117.62 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.867 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.66 -37.94 6.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.997 0.427 . . . . 10.0 111.089 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 13.8 m -95.13 169.78 9.87 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.782 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.46 142.1 39.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 70.92 -5.49 1.48 Allowed 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.573 0.546 . . . . 10.0 111.361 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -84.64 112.08 20.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.263 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -106.72 143.66 34.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.255 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.18 114.29 26.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -71.91 132.25 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.057 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.086 0.469 . . . . 10.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.683 0.278 . . . . 10.0 111.083 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -113.2 113.43 25.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.45 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 40.0 mt -90.46 121.46 32.45 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 42.1 mt -106.04 130.0 58.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.088 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -101.3 170.63 8.11 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.625 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -59.15 -24.6 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -81.65 -2.65 51.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.319 . . . . 10.0 111.454 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.66 12.64 74.59 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.812 -0.709 . . . . 10.0 111.561 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.48 124.45 28.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.86 121.83 41.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.018 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -113.51 112.55 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.777 0.323 . . . . 10.0 111.504 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 13.8 mm -89.54 119.25 36.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.2 t -104.55 134.99 44.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 69.2 tttt -62.69 128.94 38.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 29.8 ttt180 -52.27 -38.04 57.13 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.379 0.424 . . . . 10.0 112.098 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -54.59 -44.17 72.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.924 0.392 . . . . 10.0 111.206 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -80.22 -35.06 36.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.169 0.509 . . . . 10.0 110.215 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.36 87.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.51 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 74.6 mt -58.71 -50.67 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.585 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.26 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.486 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.2 m -64.99 -34.65 78.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.167 0.508 . . . . 10.0 109.858 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.87 -2.05 90.0 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.824 -0.625 . . . . 10.0 112.291 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -88.59 -23.4 23.12 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 17.3 mt -80.76 152.78 4.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -72.26 80.86 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 10.0 110.769 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.33 165.98 14.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.42 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 85.5 mmm -78.85 40.4 0.39 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.26 -24.76 64.02 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.344 -0.614 . . . . 10.0 109.344 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.33 14.36 13.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.01 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.22 -61.73 6.99 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 115.835 -0.621 . . . . 10.0 113.138 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -71.49 -165.87 0.22 Allowed 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.679 2.253 . . . . 10.0 112.243 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.0 -51.57 10.17 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.589 -0.815 . . . . 10.0 112.219 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -144.15 142.53 30.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.82 0.343 . . . . 10.0 110.233 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -114.22 88.45 2.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.757 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.84 161.53 30.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.077 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.35 -31.0 69.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.331 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -64.11 -38.5 91.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.152 0.501 . . . . 10.0 110.254 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -73.4 -24.69 60.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.637 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -78.34 -11.63 59.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.051 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -86.46 -55.34 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.674 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -129.75 91.65 3.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.359 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 t -78.24 124.38 36.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.309 -0.405 . . . . 10.0 109.961 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -98.79 106.26 18.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 10.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -88.05 91.35 8.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.159 0.504 . . . . 10.0 110.939 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -76.09 134.91 39.9 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.29 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 77.47 4.6 3.1 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 124.018 0.824 . . . . 10.0 112.174 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 72.8 mt -109.18 115.97 55.9 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.549 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -67.31 151.25 80.99 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 123.104 2.536 . . . . 10.0 111.926 179.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.1 p -63.0 -37.87 88.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.64 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -55.66 -55.27 34.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.901 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.6 -31.6 53.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.627 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 25.8 tp -65.54 -40.01 92.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.934 0.397 . . . . 10.0 110.102 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -62.32 -34.93 77.58 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.113 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -64.95 -39.81 94.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.894 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.73 -49.22 76.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.361 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 63.3 m -57.01 -41.39 78.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.158 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -64.51 -41.11 96.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.128 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -65.48 -41.83 92.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.652 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -63.57 -45.04 92.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.286 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 46.4 m -59.33 -43.97 92.67 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.451 0.643 . . . . 10.0 109.68 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -63.76 -44.59 93.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.135 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -61.39 -40.39 94.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.938 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.16 -52.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.858 0.361 . . . . 10.0 110.589 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -70.81 -38.24 73.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.248 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -56.73 -50.24 72.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.045 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.84 -13.33 59.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.87 0.367 . . . . 10.0 111.84 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -88.64 -44.82 10.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 68' ' ' SER . . . . . 0.433 ' C ' ' H ' ' C' ' 70' ' ' THR . 0.6 OUTLIER -154.39 -31.0 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.873 0.694 . . . . 10.0 112.873 -179.258 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 29.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 70' ' ' THR . . . . . 0.433 ' H ' ' C ' ' C' ' 68' ' ' SER . 0.2 OUTLIER -80.1 -1.22 39.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.216 0.531 . . . . 10.0 110.399 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -76.5 -24.52 53.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.396 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 31.7 pt -96.13 166.17 14.87 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.428 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.86 175.74 8.58 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.928 2.419 . . . . 10.0 112.661 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -72.59 171.72 11.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.476 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -50.77 128.6 27.18 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.675 0.274 . . . . 10.0 111.043 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -53.89 128.01 27.91 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.185 2.59 . . . . 10.0 112.979 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 17.1 pt -85.48 41.72 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.149 0.499 . . . . 10.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -90.96 -55.89 0.26 Allowed Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.96 -0.563 . . . . 10.0 112.456 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -72.14 128.58 14.05 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.888 1.725 . . . . 10.0 111.011 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -75.2 0.46 16.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.0 mm -85.85 99.35 7.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.272 0.558 . . . . 10.0 111.35 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.02 -42.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.049 -0.978 . . . . 10.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 29.1 tp -65.84 -26.86 67.85 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -62.91 -31.84 72.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.9 -1.045 . . . . 10.0 109.884 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 66.4 mt -79.72 -35.12 39.41 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -23.99 67.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.403 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 49.5 ttp -58.99 -28.95 66.85 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.269 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.03 -43.07 86.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.16 -52.42 0.59 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.164 1.172 . . . . 10.0 114.164 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -79.61 25.15 0.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.294 0.479 . . . . 10.0 112.294 -178.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 . . . . . 0 C--O 1.244 0.791 0 CA-C-O 118.699 -0.667 . . . . 10.0 109.625 179.557 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -62.89 1.53 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 37.3 tp -61.01 -34.01 74.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.982 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.53 -30.23 66.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.133 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -98.63 -38.32 9.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.02 0.438 . . . . 10.0 110.473 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 77.5 mt -63.4 -35.7 81.29 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.94 -0.573 . . . . 10.0 112.233 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.38 92.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 10.0 110.329 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.99 -22.83 62.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.125 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.17 -9.54 59.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.309 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.14 -51.16 3.08 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.407 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.2 129.11 29.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.736 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 mp -91.28 97.65 7.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -111.53 103.68 55.32 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.951 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -97.05 45.17 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.429 2.753 . . . . 10.0 111.611 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -93.28 -178.08 4.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.413 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -82.33 147.86 28.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.21 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.7 mm -110.33 106.45 20.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.15 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -121.87 135.49 25.32 Favored Pre-proline 0 C--N 1.32 -0.695 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -34.25 135.12 0.13 Allowed 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 124.176 3.251 . . . . 10.0 113.6 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -56.64 141.09 91.49 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 123.293 2.662 . . . . 10.0 112.511 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.81 118.42 72.31 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.763 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.98 -21.27 64.22 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.391 2.727 . . . . 10.0 113.165 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -63.97 -34.55 78.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.818 0.342 . . . . 10.0 111.095 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.3 t -122.68 -112.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -175.21 61.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.185 0.517 . . . . 10.0 111.095 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -159.85 151.87 20.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.447 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -70.76 156.64 39.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.818 0.342 . . . . 10.0 110.744 179.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.01 170.81 7.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.107 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -119.88 111.89 18.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.844 0.354 . . . . 10.0 110.741 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.57 -72.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.183 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.41 -62.63 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.309 -0.853 . . . . 10.0 109.511 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.877 0.37 . . . . 10.0 111.022 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -166.69 121.72 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.671 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.27 117.14 48.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.996 0.427 . . . . 10.0 110.856 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -104.25 115.47 30.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.653 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.71 156.33 45.12 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.892 0.377 . . . . 10.0 111.37 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 55.2 mtm -125.61 111.81 15.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.874 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -82.19 104.32 10.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -100.27 97.39 8.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.0 ttp85 -89.19 75.71 7.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.7 -1.222 . . . . 10.0 107.7 177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 67.13 -87.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.448 -178.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -113.67 11.09 18.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 10.0 111.001 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.8 m -116.61 96.92 5.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.383 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 24.6 m -96.13 121.14 37.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.897 0.38 . . . . 10.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 51.1 mt -112.21 119.19 59.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.358 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.16 122.84 26.18 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.2 m -116.6 118.39 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.036 0.446 . . . . 10.0 112.003 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -103.4 101.58 11.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.96 -169.4 2.03 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.275 0.36 . . . . 10.0 110.784 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -127.54 163.82 23.33 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.6 -25.83 64.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -18.94 60.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.839 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.8 m -71.68 141.26 49.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.615 -0.266 . . . . 10.0 110.729 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 20.3 p -91.78 163.96 13.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.625 -0.261 . . . . 10.0 110.63 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.78 -36.32 76.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.925 0.393 . . . . 10.0 110.577 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -61.29 -36.13 79.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.645 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -63.33 -34.26 77.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.171 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.58 -42.58 99.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.0 -32.03 73.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.283 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.0 mtp180 -66.08 -39.5 90.09 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 70.1 mt -67.33 -43.46 87.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -61.57 -38.09 79.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.432 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.41 -30.12 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.537 . . . . 10.0 110.271 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.73 -0.14 86.2 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.869 -0.682 . . . . 10.0 112.362 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.9 mt -115.64 -55.29 4.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 10.0 111.079 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 66.4 mt -88.42 -11.5 45.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.453 -0.339 . . . . 10.0 111.138 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.4 mttt 55.7 52.84 10.31 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.918 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.63 146.57 62.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.689 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -54.49 121.76 10.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.963 2.442 . . . . 10.0 112.268 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.74 -16.65 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.783 2.322 . . . . 10.0 111.928 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -26.75 65.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.387 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -101.22 9.62 41.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.229 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -95.03 131.12 41.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 56.8 mmt-85 -117.9 114.26 22.96 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 82.1 mt -94.15 117.77 30.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.779 0.324 . . . . 10.0 110.56 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -111.44 124.5 52.39 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 112.268 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 38.9 tttm -127.22 128.34 45.9 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 61.59 31.66 18.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.899 0.381 . . . . 10.0 110.642 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 70.91 13.44 7.04 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.378 -0.828 . . . . 10.0 111.89 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -124.25 144.89 49.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.804 0.335 . . . . 10.0 111.039 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 42.4 tp -73.26 127.69 33.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.502 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 97.1 mt -70.46 155.76 40.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.027 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -87.27 118.21 26.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.647 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.81 -28.1 68.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.825 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.91 24.39 32.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.454 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 mttp -127.78 160.16 32.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.963 0.411 . . . . 10.0 111.02 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 35.0 p -89.12 166.59 13.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.215 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.35 -40.53 86.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.01 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.07 -39.9 96.38 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.875 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -72.83 -17.39 61.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.962 0.41 . . . . 10.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 60.2 m -94.91 5.96 50.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.728 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.52 16.89 63.17 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.71 -0.757 . . . . 10.0 113.355 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -84.64 63.62 8.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.151 0.5 . . . . 10.0 110.451 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 3.5 p -84.85 149.83 25.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.12 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 2.3 m -62.49 -21.58 65.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.992 0.425 . . . . 10.0 110.673 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -63.76 -30.26 71.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.208 -0.451 . . . . 10.0 109.904 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.16 5.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.751 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -90.58 87.84 6.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.164 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -100.11 159.55 29.51 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.112 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.86 -16.76 55.84 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.638 2.225 . . . . 10.0 111.897 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.67 5.95 16.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.442 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . 0.423 ' CB ' ' H ' ' B' ' 112' ' ' ALA . . . -156.26 79.05 4.08 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.339 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.29 141.78 29.37 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.612 2.208 . . . . 10.0 111.545 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.09 123.53 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.069 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 123.6 24.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.571 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 21.0 t -123.77 129.19 74.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.55 133.43 11.8 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.697 -0.763 . . . . 10.0 111.896 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.4 tp -110.29 99.1 8.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.009 0.433 . . . . 10.0 111.116 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -95.65 114.3 26.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.013 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -97.84 118.77 35.15 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -83.46 100.86 11.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.146 0.498 . . . . 10.0 111.244 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -120.36 141.11 50.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.695 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.61 137.51 54.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 4.7 t70 70.79 11.81 7.16 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.409 0.623 . . . . 10.0 110.854 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 9.4 m -111.68 98.85 7.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.214 0.531 . . . . 10.0 111.063 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -72.78 -17.92 61.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.576 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.98 -26.05 59.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.641 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.67 -16.8 61.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.71 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 58.7 mt -93.4 -15.57 25.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.949 0.404 . . . . 10.0 111.345 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 24.0 m -91.93 -30.26 16.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.115 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 7.2 mt -85.45 -3.3 8.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.29 0.567 . . . . 10.0 110.597 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -100.38 110.29 59.59 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.152 -0.477 . . . . 10.0 111.079 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.72 -1.67 10.71 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.027 2.485 . . . . 10.0 111.736 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -84.57 -24.37 29.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.195 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -112.79 -39.4 4.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.599 -0.728 . . . . 10.0 111.064 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 25.5 m -117.34 155.62 49.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.978 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.16 154.98 42.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.558 2.172 . . . . 10.0 111.912 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.44 135.22 68.15 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.855 2.37 . . . . 10.0 112.014 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -76.69 106.08 8.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.316 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.4 tp -141.64 121.29 8.2 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.687 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -64.81 133.15 35.13 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.535 2.157 . . . . 10.0 111.687 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -60.72 -27.67 68.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.53 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 18.1 m -65.02 -25.14 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.279 0.561 . . . . 10.0 110.586 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 83.4 mmm -121.47 54.88 1.1 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.281 -1.007 . . . . 10.0 108.281 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -126.87 -54.96 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.465 -0.789 . . . . 10.0 112.445 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -82.23 70.11 7.18 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.633 2.222 . . . . 10.0 111.645 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -128.64 -167.41 1.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.796 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -93.41 179.78 5.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 8.6 m -110.7 136.57 49.58 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.66 0.267 . . . . 10.0 110.402 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -86.35 -147.71 11.07 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.511 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 3.6 m -111.66 -22.47 11.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.334 0.588 . . . . 10.0 110.348 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -86.63 159.79 19.1 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.604 -0.725 . . . . 10.0 109.918 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . 0.423 ' H ' ' CB ' ' B' ' 71' ' ' ALA . . . -64.4 121.95 15.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 t30 69.94 17.28 7.51 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.782 0.677 . . . . 10.0 111.572 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -81.78 129.54 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.995 0.426 . . . . 10.0 110.249 179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -110.13 143.04 40.79 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.097 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.09 105.76 13.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.353 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.9 t -72.38 137.65 23.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.911 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.5 mp0 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.494 179.635 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.89 0.376 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -104.16 108.36 19.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.174 -0.467 . . . . 10.0 111.181 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 47.8 mt -81.8 126.66 32.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.9 mt -108.13 114.14 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.813 0.34 . . . . 10.0 110.582 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.66 165.66 16.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.674 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m -61.65 -25.68 67.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.908 0.385 . . . . 10.0 111.655 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -79.02 0.15 28.86 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.647 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.71 26.22 59.15 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -91.08 138.79 31.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.44 . . . . 10.0 110.381 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.58 132.53 49.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.316 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -125.12 106.85 10.22 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.257 -0.428 . . . . 10.0 109.983 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 27.4 mm -88.68 110.81 21.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.148 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 43.1 t -98.51 125.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.04 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -59.74 128.25 35.99 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.298 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.0 ttt-85 -53.28 -31.26 42.94 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.33 -0.395 . . . . 10.0 111.639 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -52.34 -44.8 65.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.078 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -87.09 -30.03 21.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.514 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.44 73.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.025 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.1 -46.87 87.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.739 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 4.6 m -72.61 -36.21 68.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.408 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 27.5 m -65.26 -24.07 67.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.146 0.498 . . . . 10.0 110.301 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.71 -8.33 82.96 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.694 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -87.74 -19.57 27.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.454 0.645 . . . . 10.0 109.584 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -79.21 148.35 6.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.313 -0.858 . . . . 10.0 109.312 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.7 79.8 0.84 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 10.0 110.697 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.01 172.87 8.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.313 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.8 mmm -82.87 38.59 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.11 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mp -66.8 -32.57 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.288 0.566 . . . . 10.0 109.811 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -90.17 14.54 12.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.957 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.56 -62.5 3.83 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.657 -0.701 . . . . 10.0 112.89 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.99 -167.5 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.726 2.284 . . . . 10.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.63 -90.01 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.962 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -116.08 132.33 56.69 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.706 -0.291 . . . . 10.0 110.534 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.76 92.95 8.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.306 -0.406 . . . . 10.0 109.987 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.73 176.51 8.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.187 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.37 -25.74 68.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.268 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.86 -48.07 78.18 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -70.46 -24.45 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.246 -0.888 . . . . 10.0 111.324 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 5.1 m -78.29 -47.05 18.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.017 0.437 . . . . 10.0 110.621 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -70.83 -44.16 67.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.878 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -128.62 103.27 7.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.436 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 104.69 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -84.22 128.5 34.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.669 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -109.15 124.43 50.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -96.41 128.1 43.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.334 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 67.48 19.76 9.93 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 10.0 112.79 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 67.2 mt -113.45 111.4 49.54 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.212 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.7 143.57 46.68 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 123.038 2.492 . . . . 10.0 111.645 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -34.9 70.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.904 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.11 -55.54 31.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 10.0 111.742 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.6 m -71.33 -30.42 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.99 -0.284 . . . . 10.0 111.002 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 43.9 tp -64.34 -35.9 82.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.447 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -59.59 -39.76 85.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.589 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -65.73 -36.18 82.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.315 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 36.3 t -68.53 -44.28 83.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.64 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.28 -42.3 98.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.614 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 72.1 mtm -66.4 -35.21 79.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.467 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -65.21 -42.65 93.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.174 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -62.39 -47.44 84.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.703 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.0 m -57.53 -42.46 82.92 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.944 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -64.48 -45.57 86.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.364 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptt -63.79 -34.83 78.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 112.006 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.01 -40.76 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.102 0.477 . . . . 10.0 110.52 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -84.52 -34.45 23.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.737 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -57.71 -57.33 13.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.027 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.97 54.47 3.1 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -162.16 -58.87 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.322 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.58 -33.82 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.634 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -87.12 35.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.082 0.468 . . . . 10.0 111.949 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -9.76 59.09 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.012 0.434 . . . . 10.0 110.535 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -92.95 -9.54 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.658 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 34.1 pt -100.17 164.36 16.53 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.155 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.61 164.23 27.2 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.625 2.217 . . . . 10.0 112.948 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.63 170.63 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.315 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -48.15 128.24 12.3 Favored Pre-proline 0 C--O 1.233 0.197 0 O-C-N 123.295 0.372 . . . . 10.0 110.824 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.96 121.77 5.45 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.545 2.83 . . . . 10.0 113.395 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 2.7 pt -80.15 45.81 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.576 -0.738 . . . . 10.0 111.855 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -102.21 -57.5 0.1 Allowed Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 112.724 0.639 . . . . 10.0 112.724 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.37 97.01 1.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.202 1.935 . . . . 10.0 111.59 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.28 59.81 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.684 0.624 . . . . 10.0 112.684 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.1 mm -116.25 13.73 7.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.879 0.847 . . . . 10.0 108.942 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.56 -38.43 54.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.328 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.58 -30.07 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.137 0.494 . . . . 10.0 110.126 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 -61.42 -35.77 78.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.397 -0.82 . . . . 10.0 109.827 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.73 -33.55 35.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.335 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.13 -27.15 69.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.685 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.2 ttp -59.5 -20.73 57.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.767 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -42.06 88.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.606 0.241 . . . . 10.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.59 -50.94 0.51 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -79.98 12.15 2.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.883 0.373 . . . . 10.0 111.586 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.329 179.863 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.316 -0.314 . . . . 10.0 112.316 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -67.93 0.28 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.164 0.801 . . . . 10.0 113.164 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.95 -32.31 73.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.585 -0.279 . . . . 10.0 111.514 -178.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -57.6 -42.77 83.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.041 0.448 . . . . 10.0 110.25 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -78.88 -40.28 32.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.994 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.02 -32.77 72.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.62 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.86 -43.52 92.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.791 0.329 . . . . 10.0 110.544 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 tp -70.27 -22.73 62.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.44 0.638 . . . . 10.0 109.956 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.77 2.23 56.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.368 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -114.07 -39.41 3.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.157 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -156.68 118.91 3.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.016 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.1 mt -86.48 85.57 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 ttpt -96.21 111.89 57.98 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.159 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -95.46 36.04 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.315 2.677 . . . . 10.0 111.352 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -82.29 -177.95 6.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.341 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -87.35 166.03 15.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.547 0.573 . . . . 10.0 112.547 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.0 mm -116.41 143.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.691 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.83 143.03 2.52 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -43.74 140.28 4.72 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.258 2.639 . . . . 10.0 112.526 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.84 139.28 67.64 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.859 2.373 . . . . 10.0 111.826 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 125.72 87.19 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.66 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.59 -11.03 30.09 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.097 2.531 . . . . 10.0 112.936 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -42.38 76.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.135 0.493 . . . . 10.0 110.478 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -119.5 -125.51 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -159.41 55.56 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.38 0.61 . . . . 10.0 110.727 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.9 tttm -153.06 154.11 34.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.408 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.52 156.38 32.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.716 0.293 . . . . 10.0 110.935 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.53 169.91 9.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.601 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -122.32 119.41 31.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.03 0.443 . . . . 10.0 110.967 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -153.17 -68.25 0.15 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.991 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.413 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.0 -56.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.806 -0.616 . . . . 10.0 109.875 179.908 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tmm? . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 121.02 0.438 . . . . 10.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -79.23 137.17 37.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.003 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 98.3 t -123.6 119.49 57.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.29 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -109.3 115.03 29.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.994 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.13 159.75 36.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.811 0.339 . . . . 10.0 111.39 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 35.0 mtm -127.52 106.17 8.99 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.862 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 45.8 mm -78.36 105.39 7.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -107.62 104.15 13.62 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 -178.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -92.54 76.39 5.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.339 -1.356 . . . . 10.0 107.339 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 67.6 -81.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.428 -0.805 . . . . 10.0 111.083 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 mttt -113.87 -12.65 12.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.94 0.4 . . . . 10.0 111.743 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.5 105.14 17.37 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.6 m -106.68 120.48 42.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.63 0.253 . . . . 10.0 111.24 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 58.3 mt -113.44 118.09 57.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.81 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -77.26 118.42 19.73 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -110.02 116.74 32.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.448 0.642 . . . . 10.0 112.003 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -101.59 97.99 8.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.706 -1.22 . . . . 10.0 107.706 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.44 -169.69 1.9 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.222 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -127.43 158.49 37.2 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.73 -20.7 61.81 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.467 0.543 . . . . 10.0 112.467 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.19 -15.29 58.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.835 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 20.1 m -81.09 143.27 32.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.742 0.306 . . . . 10.0 111.367 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -90.55 168.28 11.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.455 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 57.2 t -64.63 -34.32 69.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.638 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -62.2 -35.94 80.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.412 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -63.5 -29.8 71.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.105 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 81.1 mt -67.21 -47.31 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.514 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 91.3 mttt -61.36 -33.34 73.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.877 -0.602 . . . . 10.0 110.573 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.55 -34.31 77.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.138 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.1 mt -70.57 -46.85 68.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.67 -36.41 73.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.327 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -57.58 -40.25 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.69 -14.66 79.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.85 -0.691 . . . . 10.0 113.241 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 88.0 mt -95.42 -51.94 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 122.663 -0.316 . . . . 10.0 111.399 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 46.1 mt -85.54 -11.63 53.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.452 0.538 . . . . 10.0 112.452 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.7 mttm 60.92 41.24 14.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -131.82 151.55 78.76 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.85 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.42 131.51 46.67 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.308 2.672 . . . . 10.0 112.589 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.95 -20.9 11.33 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.877 2.384 . . . . 10.0 111.971 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -70.68 -23.74 62.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -98.87 11.41 38.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.349 0.595 . . . . 10.0 111.194 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -99.42 133.33 43.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.469 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 47.5 mmt-85 -115.0 118.22 32.8 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 41.1 mt -96.93 114.18 25.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.844 0.354 . . . . 10.0 111.144 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -112.33 127.23 55.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.137 0.494 . . . . 10.0 111.569 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -137.22 128.82 28.57 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.31 39.05 15.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.91 0.386 . . . . 10.0 111.214 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 64.27 17.06 10.51 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.353 -0.839 . . . . 10.0 111.808 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -128.72 155.19 45.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.858 0.361 . . . . 10.0 111.286 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.94 133.71 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.9 mt -76.77 155.95 32.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.835 0.35 . . . . 10.0 111.511 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -100.95 114.1 27.69 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.366 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.514 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 2.3 m-20 -64.86 -15.7 62.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.725 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.88 14.54 64.55 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.885 -0.674 . . . . 10.0 112.751 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -130.72 160.9 32.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.753 0.311 . . . . 10.0 110.693 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 43.4 p -86.6 165.56 16.09 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.405 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 84.7 mt -57.63 -39.68 77.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.398 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.06 85.33 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.998 -0.62 . . . . 10.0 112.382 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -81.15 -12.98 59.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.905 0.383 . . . . 10.0 111.507 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 57.8 m -96.83 2.27 51.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 10.0 111.105 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.41 9.09 62.04 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.736 -0.745 . . . . 10.0 113.32 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -86.28 62.6 7.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.233 0.539 . . . . 10.0 110.39 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.7 p -88.21 154.2 20.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.544 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.9 m -61.76 -15.36 40.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.053 0.454 . . . . 10.0 111.313 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -72.18 -38.21 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.263 0.554 . . . . 10.0 109.966 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.08 -46.11 7.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.554 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.76 92.85 9.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -99.4 154.11 37.45 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.17 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.96 -13.62 38.45 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.87 2.38 . . . . 10.0 112.078 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -110.39 0.69 18.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.217 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . 0.417 ' CB ' ' H ' ' B' ' 112' ' ' ALA . . . -157.9 89.27 2.37 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.586 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.03 141.78 30.22 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.742 2.295 . . . . 10.0 111.568 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.13 116.44 12.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.891 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.34 128.2 35.51 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.555 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 24.3 t -125.42 131.34 72.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.99 122.82 6.42 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.669 -0.777 . . . . 10.0 111.877 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.6 tp -101.53 106.16 17.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 10.0 111.128 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.07 105.51 16.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.458 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.04 117.65 30.04 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -81.7 106.19 13.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.008 0.432 . . . . 10.0 111.573 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.78 128.18 54.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.3 143.2 57.21 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.917 -0.313 . . . . 10.0 111.276 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.29 -3.39 1.85 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.515 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.46 96.17 5.29 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.539 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -77.72 12.65 1.59 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.955 -178.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -62.84 -26.83 68.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.65 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.08 78.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.972 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -70.0 -33.16 71.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.795 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.7 m -74.71 -30.78 61.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.774 -0.648 . . . . 10.0 111.21 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 59.0 mt -84.33 -35.29 10.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.252 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.04 115.36 13.79 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.633 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.93 -14.96 46.97 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.294 2.663 . . . . 10.0 112.51 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.59 -37.65 62.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.026 0.441 . . . . 10.0 110.147 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.37 -35.91 12.16 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.657 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 1.4 m -128.53 144.62 52.78 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.508 -0.314 . . . . 10.0 111.192 -179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.33 145.82 60.88 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.377 2.052 . . . . 10.0 111.083 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.66 128.61 28.92 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.896 2.397 . . . . 10.0 111.624 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -63.01 111.01 1.99 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.918 -0.583 . . . . 10.0 112.174 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 26.4 tp -131.08 131.56 23.25 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.048 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.52 128.65 24.14 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 122.686 2.257 . . . . 10.0 111.733 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -65.41 -37.65 87.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.439 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.22 -20.86 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.318 0.58 . . . . 10.0 110.694 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 74.3 mmm -114.65 52.98 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.027 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -126.27 -54.22 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 112.778 0.658 . . . . 10.0 112.778 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.84 63.35 5.84 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.098 1.865 . . . . 10.0 111.858 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -128.92 -173.93 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.813 -0.631 . . . . 10.0 109.609 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.92 178.58 5.24 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.706 -0.397 . . . . 10.0 111.096 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -96.44 139.61 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.723 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -89.13 -156.71 32.01 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.26 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.84 -34.23 16.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.092 0.472 . . . . 10.0 110.553 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m -84.48 162.82 19.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.067 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . 0.417 ' H ' ' CB ' ' B' ' 71' ' ' ALA . . . -70.18 129.08 38.41 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.17 4.45 4.9 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.757 0.661 . . . . 10.0 111.511 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -75.4 141.06 43.3 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -118.19 147.19 43.61 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.091 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -120.32 109.86 15.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.225 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.23 137.41 22.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.122 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.859 179.273 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.235 0.304 0 CA-C-O 120.932 0.396 . . . . 10.0 110.732 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -102.42 111.15 23.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 66.3 mt -92.2 111.37 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -97.37 122.43 48.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.975 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 10.3 p -95.34 171.47 8.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.804 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.8 m -70.19 -7.59 43.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.839 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -91.64 -3.63 56.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.01 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.39 5.66 84.78 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.16 -0.776 . . . . 10.0 111.16 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.11 121.2 26.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -102.52 120.47 40.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.274 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -106.9 123.57 48.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.211 -0.45 . . . . 10.0 111.547 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 17.4 mm -100.7 117.69 46.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.844 -0.798 . . . . 10.0 108.844 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.15 139.68 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.603 -0.147 . . . . 10.0 110.603 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 56.2 tttt -56.44 130.41 44.72 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -53.99 -37.99 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.759 0.281 . . . . 10.0 111.759 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.84 -53.21 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 10.0 110.842 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -66.77 -36.57 82.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.717 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.14 86.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.827 179.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.27 -52.02 66.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.701 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -60.81 -41.43 95.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.731 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -64.74 -39.28 93.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.715 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.76 -10.88 80.64 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.121 -0.561 . . . . 10.0 112.662 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -82.69 -15.26 52.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.508 0.671 . . . . 10.0 109.743 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.1 mt -88.34 159.63 2.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -67.33 86.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.105 0.479 . . . . 10.0 111.435 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.92 165.91 11.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.969 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 96.3 mmm -76.8 41.89 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.92 -28.68 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.263 0.554 . . . . 10.0 109.835 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.89 15.49 22.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.236 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.45 -64.54 3.92 Favored Glycine 0 CA--C 1.52 0.391 0 CA-C-N 115.758 -0.655 . . . . 10.0 113.039 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.72 -154.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.612 2.208 . . . . 10.0 111.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.57 -94.95 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.743 -0.741 . . . . 10.0 112.089 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -113.41 112.01 22.92 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.827 0.346 . . . . 10.0 110.728 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -81.6 100.71 9.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.528 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.07 156.56 39.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.619 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.78 -37.29 73.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.073 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -62.96 -36.53 83.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -71.7 -31.5 66.82 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.206 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -73.75 -32.93 64.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.979 0.419 . . . . 10.0 110.306 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -75.59 -37.73 59.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -132.55 88.31 2.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.731 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.5 117.71 26.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.374 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -95.73 110.87 22.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.244 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -94.66 115.58 27.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.895 0.379 . . . . 10.0 111.354 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -99.07 136.83 38.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.395 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 70.15 27.48 4.22 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.893 0.746 . . . . 10.0 111.703 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 78.4 mt -132.89 109.92 13.05 Favored Pre-proline 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.307 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.89 152.22 83.01 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.912 2.408 . . . . 10.0 112.575 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.3 p -63.99 -34.44 78.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.946 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.17 -57.7 10.15 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -179.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.8 m -64.77 -35.24 74.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.427 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.5 tp -63.98 -37.51 87.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.61 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 35.5 m -59.71 -40.67 88.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.584 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -68.49 -35.94 78.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.337 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 78.4 t -62.97 -47.98 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.27 -40.95 92.19 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.553 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.6 mtm -65.55 -41.31 93.13 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -65.43 -40.83 93.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.603 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -62.66 -46.65 87.23 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 35.6 m -58.4 -44.62 89.05 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.329 0.585 . . . . 10.0 110.146 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -64.85 -41.84 95.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.36 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -63.26 -38.71 92.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.247 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.75 -47.54 92.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -71.65 -40.81 69.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.361 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.64 -47.58 83.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.981 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.59 32.39 0.79 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.968 0.413 . . . . 10.0 110.952 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -138.83 -56.01 0.61 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.649 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.04 -35.83 0.62 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.713 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 1.4 m -80.67 38.76 0.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.951 0.405 . . . . 10.0 111.892 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.01 -17.03 32.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.45 0.643 . . . . 10.0 109.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -78.46 -14.78 59.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.489 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 40.1 pt -99.46 166.85 12.15 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.377 -0.601 . . . . 10.0 109.377 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -67.79 166.61 23.77 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.201 1.934 . . . . 10.0 113.247 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -74.37 171.75 13.13 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.417 -0.957 . . . . 10.0 108.417 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -52.3 128.49 40.8 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 110.394 -0.224 . . . . 10.0 110.394 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.01 129.55 35.09 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.811 2.34 . . . . 10.0 112.249 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 40.1 pt -84.05 40.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.307 0.575 . . . . 10.0 111.437 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.69 -57.3 0.36 Allowed Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.736 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -70.17 117.0 4.86 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.789 1.66 . . . . 10.0 110.778 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -73.98 3.73 6.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 43.0 mm -83.07 82.11 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.398 0.618 . . . . 10.0 110.026 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.65 -37.36 0.12 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.428 -0.805 . . . . 10.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 20.1 tp -66.2 -25.42 66.92 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -63.39 -32.93 74.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.715 -1.129 . . . . 10.0 109.508 178.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.42 -34.2 48.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.759 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.2 -27.86 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.067 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 46.8 ttp -59.21 -25.9 64.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.548 -0.751 . . . . 10.0 111.752 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.19 -29.23 70.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.993 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.96 -65.35 0.22 Allowed 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.472 0.916 . . . . 10.0 113.472 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -80.18 33.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.896 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 112.744 -0.142 . . . . 10.0 112.744 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -56.41 22.57 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tp -57.6 -34.84 69.68 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -61.41 -37.19 82.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.045 0.45 . . . . 10.0 111.058 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -84.87 -41.95 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.52 -39.69 94.36 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.252 0.464 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.18 94.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.729 0.299 . . . . 10.0 111.011 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.83 -30.53 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.237 0.542 . . . . 10.0 110.475 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.07 -3.24 57.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.744 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.19 -41.0 5.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.426 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.61 133.14 5.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.834 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.0 mt -99.69 100.41 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -108.89 101.66 45.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 10.0 111.283 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.55 71.36 4.68 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.308 2.672 . . . . 10.0 110.717 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 mttm -128.22 177.92 6.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.064 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -83.89 144.57 29.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.093 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.13 105.21 18.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.733 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.13 140.12 23.19 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -40.36 132.53 2.31 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.47 2.78 . . . . 10.0 112.772 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.11 141.36 98.03 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.282 2.655 . . . . 10.0 112.876 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.05 135.15 55.17 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.251 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.44 -7.5 21.39 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 122.862 2.375 . . . . 10.0 112.812 -178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -38.89 80.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.394 -0.367 . . . . 10.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 t -122.29 -117.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.23 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -166.75 49.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.992 0.425 . . . . 10.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -148.52 150.61 33.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.803 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.47 156.03 37.38 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.769 0.319 . . . . 10.0 111.002 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.91 170.64 8.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.62 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -119.16 125.72 49.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -166.76 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.84 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.73 -67.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.825 -0.435 . . . . 10.0 109.825 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.672 -0.68 . . . . 10.0 110.293 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.863 0.363 . . . . 10.0 110.579 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -81.68 143.08 32.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.039 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -133.22 112.26 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.868 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -97.92 110.15 22.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.167 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.18 153.71 38.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.937 0.399 . . . . 10.0 111.431 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 36.8 mtm -123.87 110.89 15.42 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.451 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.1 mm -81.61 113.23 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.32 110.31 21.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.434 0.635 . . . . 10.0 112.635 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.5 ttp85 -103.36 68.63 0.97 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 107.034 -1.469 . . . . 10.0 107.034 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 66.16 -88.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.909 -1.041 . . . . 10.0 111.144 -178.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -96.8 -21.77 17.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.844 0.354 . . . . 10.0 111.455 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -90.1 120.3 31.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.495 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.49 125.13 48.16 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.989 -0.374 . . . . 10.0 109.989 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 63.8 mt -118.63 118.37 57.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.715 0.293 . . . . 10.0 111.6 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -80.73 115.34 20.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.6 m -112.08 112.32 23.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.076 0.465 . . . . 10.0 112.248 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.62 100.75 13.43 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.639 -1.245 . . . . 10.0 107.639 177.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -120.65 -173.44 2.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.879 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 mmtt -125.88 160.57 29.55 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.03 -25.44 66.91 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.055 0.455 . . . . 10.0 111.203 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -2.18 49.63 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.9 m -86.74 141.28 29.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.685 0.279 . . . . 10.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 16.0 p -87.91 159.58 18.3 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.544 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 t -63.31 -35.22 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.919 0.39 . . . . 10.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.91 -35.94 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.58 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.95 -34.62 78.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.048 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.4 mt -63.73 -44.98 91.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.27 -34.26 77.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.125 179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -65.64 -39.44 91.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.146 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.7 mt -66.2 -42.73 91.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -63.14 -37.91 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.445 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.67 -33.67 76.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.499 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.84 -26.57 66.69 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.495 -0.86 . . . . 10.0 112.458 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.4 mt -91.37 -57.49 4.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 70.0 mt -83.45 -15.48 49.44 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.384 0.512 . . . . 10.0 112.384 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.8 mttt 64.16 31.72 13.07 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.147 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -112.91 132.18 22.44 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.142 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 125.85 10.54 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.695 2.93 . . . . 10.0 113.436 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.23 -20.39 43.25 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.938 2.425 . . . . 10.0 112.102 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.33 -31.76 73.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.287 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -98.97 10.86 40.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.036 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -93.67 128.37 39.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.859 0.362 . . . . 10.0 110.825 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 70.0 mmt-85 -118.72 111.2 18.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.031 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -93.28 121.14 34.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -114.78 122.12 45.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.13 0.49 . . . . 10.0 111.74 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -118.19 123.52 45.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.401 -0.818 . . . . 10.0 108.833 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 57.4 43.19 23.57 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.443 0.465 . . . . 10.0 111.099 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 69.33 5.92 5.4 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -119.19 147.03 44.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.736 0.303 . . . . 10.0 111.549 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.23 132.47 43.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.521 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.8 mt -78.41 171.07 15.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -83.22 -157.53 0.24 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.603 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.62 -50.65 0.46 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.097 0.475 . . . . 10.0 110.012 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.18 -21.53 54.69 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.842 -0.694 . . . . 10.0 112.845 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -73.97 157.41 36.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.949 0.404 . . . . 10.0 111.013 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 25.6 p -90.64 169.25 11.16 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.465 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 79.2 mt -62.07 -35.59 79.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.598 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.04 -22.95 65.44 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.387 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -94.75 -6.53 42.84 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.756 0.313 . . . . 10.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 44.5 m -107.84 23.05 15.06 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.046 0.387 . . . . 10.0 112.046 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.94 28.09 71.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.961 -0.638 . . . . 10.0 113.519 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -107.26 99.41 8.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.904 0.383 . . . . 10.0 110.757 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -124.31 178.05 5.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 6.1 m -75.59 4.97 6.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.502 . . . . 10.0 111.154 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -97.31 -38.15 9.77 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.46 -39.79 18.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.197 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.77 107.52 17.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.776 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -118.91 161.74 34.77 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.103 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.69 -34.73 75.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.163 2.576 . . . . 10.0 113.264 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.33 11.37 27.21 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.233 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -151.01 77.09 7.75 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.674 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.24 132.2 13.6 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.748 2.299 . . . . 10.0 111.617 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.18 122.79 18.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.546 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -78.46 126.15 30.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.478 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 42.3 t -121.77 130.33 74.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.14 135.28 13.52 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.653 -0.784 . . . . 10.0 111.84 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.3 tp -116.36 104.12 11.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.915 0.388 . . . . 10.0 111.333 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -97.95 119.55 36.77 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -98.96 123.16 43.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.286 -0.264 . . . . 10.0 110.286 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -75.03 78.09 2.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.279 0.561 . . . . 10.0 110.754 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -85.96 136.03 33.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.534 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -67.88 128.47 36.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.988 -0.551 . . . . 10.0 112.2 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.27 19.27 9.97 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.677 -0.692 . . . . 10.0 112.398 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.1 m -111.86 112.81 24.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.829 0.347 . . . . 10.0 110.529 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -77.44 -8.51 57.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.752 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -60.95 -28.63 69.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.367 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.19 -40.96 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.211 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.94 -21.31 60.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.371 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 30.5 m -83.83 -23.83 31.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.407 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 mt -90.53 -33.79 6.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.427 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.19 113.53 11.7 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.66 -2.67 11.73 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.899 2.4 . . . . 10.0 112.182 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -80.53 -45.72 16.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.353 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -88.64 -28.96 20.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.811 -0.632 . . . . 10.0 111.542 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 2.3 m -132.29 136.55 28.26 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.647 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.1 151.24 79.94 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 122.553 2.169 . . . . 10.0 111.539 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.35 127.03 24.2 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.985 2.457 . . . . 10.0 112.12 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.58 120.85 14.13 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.773 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 23.5 tp -135.69 132.48 19.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.341 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.22 127.7 25.87 Favored 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.635 2.223 . . . . 10.0 111.844 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.85 -36.47 83.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.958 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.3 m -73.15 -21.76 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.132 0.491 . . . . 10.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 74.7 mmm -111.42 62.18 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -131.27 -55.08 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.851 0.685 . . . . 10.0 112.851 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -74.74 62.42 5.62 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.484 2.123 . . . . 10.0 111.793 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -130.98 -178.24 4.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.915 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -90.35 177.69 6.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.873 0.368 . . . . 10.0 111.82 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 12.7 m -107.36 132.73 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.675 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.15 -150.59 13.05 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.984 -0.627 . . . . 10.0 113.133 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.02 -41.76 11.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.002 0.429 . . . . 10.0 111.295 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 19.5 m -79.91 166.12 21.97 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.684 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -73.55 127.9 34.01 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.0 t30 74.97 13.96 3.26 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.613 0.571 . . . . 10.0 110.954 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -85.84 121.61 28.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -106.4 146.06 30.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.081 0.467 . . . . 10.0 111.545 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.1 105.4 11.36 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.238 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.34 127.23 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.537 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.091 179.471 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.918 0.389 . . . . 10.0 110.729 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -109.12 119.07 38.42 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.18 117.84 31.55 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mp -103.63 113.2 39.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.791 0.329 . . . . 10.0 110.222 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.8 p -83.26 176.24 9.3 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.875 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.1 m -72.04 -7.06 46.66 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -93.82 -2.38 53.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.045 0.45 . . . . 10.0 109.832 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.71 9.7 80.65 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 10.0 111.867 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.12 123.09 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.676 0.274 . . . . 10.0 110.627 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -94.87 114.48 26.35 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.686 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -104.07 107.08 17.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mm -89.4 114.89 28.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.627 178.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.1 t -103.63 128.23 57.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.424 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -60.06 134.13 56.75 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -57.52 -28.81 63.81 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -55.51 -38.16 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.913 0.387 . . . . 10.0 111.139 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -95.09 -26.38 16.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.304 0.573 . . . . 10.0 110.148 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -33.51 75.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.632 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 75.2 mt -58.39 -51.5 69.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.229 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 24.0 m -65.47 -41.26 93.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.432 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 24.3 m -58.39 -41.68 85.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.857 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.32 -15.36 81.21 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.982 -0.628 . . . . 10.0 112.575 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 38.7 m -82.13 -31.86 30.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.008 0.432 . . . . 10.0 110.166 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -69.87 158.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.205 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -71.4 87.03 0.85 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.078 0.466 . . . . 10.0 110.988 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -107.24 166.01 10.95 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.167 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.0 mmm -79.03 42.91 0.49 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.937 0.347 . . . . 10.0 111.937 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.34 -18.18 60.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.221 0.534 . . . . 10.0 110.427 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 15.9 m -101.05 14.59 31.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.85 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.97 -61.18 5.42 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.105 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.48 161.06 21.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.28 1.987 . . . . 10.0 111.968 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.71 23.82 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.943 -0.571 . . . . 10.0 112.621 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -127.27 113.56 16.46 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.939 0.4 . . . . 10.0 111.398 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -91.27 94.42 9.53 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.8 172.28 9.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -63.5 -14.93 55.94 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.593 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -55.78 22.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.775 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -67.24 -31.64 72.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.939 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -62.57 -24.26 67.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.034 0.445 . . . . 10.0 111.034 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.37 -53.43 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.278 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -128.09 105.26 8.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.841 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 t -84.22 121.59 36.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.796 0.331 . . . . 10.0 110.737 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -90.39 103.82 16.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.71 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -98.19 112.88 24.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.182 0.515 . . . . 10.0 111.533 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -106.12 144.21 33.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 67.69 22.1 9.08 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.752 0.657 . . . . 10.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.2 mt -128.36 107.97 19.34 Favored Pre-proline 0 C--O 1.237 0.396 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.664 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -63.46 148.14 92.81 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.966 2.444 . . . . 10.0 111.837 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.1 p -59.76 -39.62 85.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.511 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -58.56 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 113.006 0.743 . . . . 10.0 113.006 -179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 28.3 m -62.71 -36.67 76.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 10.0 111.324 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 27.0 tp -64.09 -36.06 82.78 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.691 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 19.9 m -63.0 -40.6 98.26 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.292 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -66.79 -37.27 84.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.395 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.26 -47.26 93.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.779 178.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -61.24 -39.2 89.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.838 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.0 mtm -65.01 -42.24 94.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.045 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -67.11 -39.79 86.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.416 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -60.89 -48.81 80.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.163 -0.472 . . . . 10.0 109.899 178.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 25.7 m -59.16 -40.92 87.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.214 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -64.01 -43.08 96.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.455 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -66.61 -34.22 77.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.166 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 54.1 t -62.17 -46.4 96.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -74.57 -38.05 62.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.804 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.59 -52.17 66.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.677 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -83.76 42.01 0.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.218 0.532 . . . . 10.0 110.539 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -152.77 -62.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.583 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.62 -36.02 1.45 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.909 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 20.4 m -82.5 43.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 111.932 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 -5.01 48.91 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.603 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -92.0 -7.8 47.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.029 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 pt -102.38 161.9 21.89 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.467 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -65.67 164.48 26.44 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.749 2.3 . . . . 10.0 112.534 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.4 168.25 11.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.273 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -51.19 131.32 32.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 122.314 0.246 . . . . 10.0 110.971 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.5 124.45 15.18 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.131 2.554 . . . . 10.0 112.313 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 15.3 pt -83.64 45.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 10.0 111.231 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.22 -53.91 0.19 Allowed Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.956 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.72 98.87 0.71 Allowed 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.062 1.841 . . . . 10.0 110.725 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -68.69 3.61 1.81 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.042 0.756 . . . . 10.0 113.042 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 20.2 mm -77.66 -2.94 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.522 0.677 . . . . 10.0 110.625 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.5 -28.94 67.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.622 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 tp -77.51 -22.58 50.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.861 0.362 . . . . 10.0 110.846 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -64.79 -26.14 68.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 10.0 109.651 178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 mt -75.91 -27.31 57.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.703 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.65 -20.99 64.48 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.437 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.6 -23.62 67.46 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.915 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.98 -44.35 87.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.347 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.82 -58.57 0.39 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -78.59 19.64 0.48 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.999 0.37 . . . . 10.0 111.999 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.98 -0.533 . . . . 10.0 109.638 179.864 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 111.801 -0.52 . . . . 10.0 111.801 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -59.72 4.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.651 0.612 . . . . 10.0 112.651 -179.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 24.5 tp -65.66 -37.38 86.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.461 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -58.25 -24.5 59.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.146 0.498 . . . . 10.0 111.101 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -98.85 -46.78 5.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.104 0.478 . . . . 10.0 110.496 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.43 -34.83 78.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.06 92.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.727 0.299 . . . . 10.0 111.324 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.3 tp -68.14 -28.85 67.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.522 . . . . 10.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.56 -10.29 59.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.283 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.3 -36.04 10.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.21 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tp -151.1 121.72 7.46 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.265 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 mp -86.63 92.62 3.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.68 -0.859 . . . . 10.0 108.68 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -106.28 105.9 55.54 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.006 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -98.0 64.68 0.09 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.386 2.724 . . . . 10.0 110.802 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -124.8 170.84 10.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.018 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -77.44 145.49 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.529 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mm -116.28 99.61 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.219 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -104.92 142.05 23.84 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 107.662 -1.236 . . . . 10.0 107.662 178.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -36.1 130.92 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.586 2.858 . . . . 10.0 112.912 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.93 137.66 61.37 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.568 2.845 . . . . 10.0 113.165 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 125.08 83.31 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.252 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.95 -15.58 48.56 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.08 2.52 . . . . 10.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.19 -35.08 79.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.464 -0.335 . . . . 10.0 111.181 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -130.0 -127.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 109.996 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -155.22 52.29 0.61 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.136 0.493 . . . . 10.0 111.02 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -149.17 151.36 34.2 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -74.74 148.47 40.43 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.124 -0.324 . . . . 10.0 110.124 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.92 155.17 21.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.369 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -107.59 110.82 22.8 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -162.43 -77.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.55 -69.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.731 -1.128 . . . . 10.0 109.397 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mmm . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.758 0.313 . . . . 10.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.3 141.16 35.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.119 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 79.6 t -117.06 116.08 50.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.096 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -104.08 114.75 29.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.346 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -134.27 158.33 44.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.878 0.37 . . . . 10.0 111.445 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 60.8 mtm -125.94 117.03 22.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.418 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.4 mm -87.49 112.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -108.92 109.3 20.34 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -99.81 73.77 1.8 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.388 -1.338 . . . . 10.0 107.388 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 66.63 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.362 -0.835 . . . . 10.0 111.18 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -108.91 -24.55 11.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.947 0.404 . . . . 10.0 110.905 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.4 m -86.06 107.77 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.89 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -110.66 123.47 50.07 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.423 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 20.5 mt -118.72 122.19 68.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.758 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -79.84 121.68 25.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 2.2 m -112.11 118.36 35.17 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 10.0 111.607 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -104.09 93.58 4.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.155 -1.054 . . . . 10.0 108.155 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.2 -167.95 1.36 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.479 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -127.58 166.37 18.16 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -62.61 -23.12 66.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.892 0.377 . . . . 10.0 111.6 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.98 -9.58 59.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.716 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.7 m -81.19 142.81 32.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.69 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 57.7 p -92.21 169.6 10.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.617 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.4 t -69.7 -34.9 63.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.089 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -63.57 -35.05 79.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.349 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -62.17 -36.14 80.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.764 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -45.36 94.86 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.469 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 97.5 mttt -60.46 -40.03 89.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.053 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -62.66 -41.08 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.572 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -66.79 -47.8 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.271 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -61.6 -36.53 73.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 10.0 110.53 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -36.41 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.029 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.98 -5.88 89.37 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 121.063 -0.589 . . . . 10.0 112.791 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 69.4 mt -107.48 -50.2 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.792 0.33 . . . . 10.0 110.81 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 30.5 mt -87.14 -9.58 54.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 10.0 111.767 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.03 50.15 12.58 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.503 0.502 . . . . 10.0 111.474 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.58 142.25 31.11 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.512 -179.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.85 128.83 16.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.498 2.799 . . . . 10.0 113.102 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.86 -24.94 20.56 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 123.027 2.485 . . . . 10.0 112.743 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 t0 -68.99 -23.05 64.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.933 0.397 . . . . 10.0 111.038 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -90.7 -2.99 57.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.592 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -88.85 135.8 33.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.955 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 60.3 mmt-85 -125.46 110.81 14.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.217 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 90.4 mt -91.79 120.79 32.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.881 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -114.36 118.69 34.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.081 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -123.06 130.56 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.901 -0.777 . . . . 10.0 108.901 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 61.23 33.76 19.02 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.068 0.461 . . . . 10.0 110.242 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 65.55 21.89 11.76 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.477 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -130.78 149.15 52.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.781 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -78.13 131.42 37.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.733 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -80.15 150.76 30.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.504 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.71 124.37 39.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.817 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.469 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 1.1 m-20 -56.22 -33.6 65.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.41 -22.49 67.4 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.821 -0.704 . . . . 10.0 113.81 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.11 157.77 23.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.245 0.545 . . . . 10.0 111.796 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 26.3 p -94.19 167.49 11.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.467 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.08 -43.16 91.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.764 0.316 . . . . 10.0 111.724 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.52 -35.44 72.79 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.952 -0.642 . . . . 10.0 113.061 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -79.4 -17.83 53.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.809 0.337 . . . . 10.0 111.298 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.3 m -90.47 6.57 42.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.649 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.22 16.64 53.12 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.565 -0.826 . . . . 10.0 112.716 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -92.04 90.31 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.837 0.351 . . . . 10.0 110.145 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 39.4 p -116.02 176.83 4.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.99 -0.13 6.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 10.0 111.592 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -95.0 -51.14 4.79 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.861 0.362 . . . . 10.0 110.241 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.99 -25.46 43.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.931 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -119.25 95.88 4.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.135 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -119.0 156.79 51.85 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.767 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.32 -15.14 48.61 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.419 2.079 . . . . 10.0 111.228 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.39 -7.48 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.605 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -160.84 92.08 1.56 Allowed Pre-proline 0 C--O 1.235 0.297 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.675 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -80.56 130.28 7.79 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.904 2.403 . . . . 10.0 111.376 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.55 127.29 30.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.626 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m -85.78 127.18 34.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.056 0.455 . . . . 10.0 111.617 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.2 t -121.74 133.24 68.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.382 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.04 137.64 17.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.775 -0.726 . . . . 10.0 111.577 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 tp -116.89 109.63 17.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.071 0.463 . . . . 10.0 111.887 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.69 151.7 20.44 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -128.37 123.37 33.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.746 0.307 . . . . 10.0 110.808 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -74.64 89.18 2.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.177 0.513 . . . . 10.0 111.191 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -119.78 129.87 54.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.588 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.04 137.62 49.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.038 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 69.5 13.21 8.33 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.596 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.6 m -116.92 96.21 5.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.621 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.23 -8.83 57.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.708 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -60.11 -31.56 70.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.451 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.32 88.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.161 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.43 -21.6 64.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 16.2 m -84.04 -18.14 38.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.111 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.48 -29.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.856 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.58 116.06 23.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.217 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.79 -14.36 44.24 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.004 2.469 . . . . 10.0 111.953 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -91.86 -15.61 27.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 10.9 m -103.17 -30.94 10.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.885 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 69.2 m -148.68 147.1 23.74 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.44 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.6 138.78 50.88 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.311 2.008 . . . . 10.0 111.282 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.92 125.42 8.25 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.217 2.611 . . . . 10.0 111.75 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -56.09 113.46 1.54 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.634 -0.712 . . . . 10.0 111.873 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 23.2 tp -143.87 125.41 8.16 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.419 -0.809 . . . . 10.0 109.279 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -64.83 123.72 12.07 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.8 2.333 . . . . 10.0 111.997 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -63.21 -30.28 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.176 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -66.77 -14.01 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.297 0.57 . . . . 10.0 110.116 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 78.4 mmm -123.08 34.8 5.03 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 tttm -105.6 -49.1 0.12 Allowed Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 113.029 0.752 . . . . 10.0 113.029 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -73.67 63.02 4.71 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.0 1.8 . . . . 10.0 112.688 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -133.6 150.31 51.61 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.74 148.98 45.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.584 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.8 m -76.17 141.52 41.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.979 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -84.88 -144.15 6.66 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.52 -37.04 12.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.119 0.485 . . . . 10.0 110.658 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 66.4 m -80.65 161.94 24.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.671 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.83 126.68 28.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.016 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 66.06 14.71 9.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.064 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -76.43 136.2 39.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.799 0.333 . . . . 10.0 110.176 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -115.37 144.41 43.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.812 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -130.33 113.15 14.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.007 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.39 126.33 36.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.44 -0.346 . . . . 10.0 110.392 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.474 -0.33 . . . . 10.0 111.534 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.065 0.46 . . . . 10.0 111.321 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -118.07 115.93 25.84 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.766 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.6 mt -87.8 124.33 33.51 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.774 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt -107.61 113.07 42.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -83.82 166.26 18.1 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.653 -0.249 . . . . 10.0 111.019 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -68.69 -10.52 56.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.493 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -84.48 -11.84 55.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.157 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.98 28.46 20.83 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.147 -0.781 . . . . 10.0 111.147 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -106.46 133.09 51.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.171 -0.307 . . . . 10.0 110.171 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -98.2 129.82 44.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.354 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -123.23 101.12 7.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.68 0.276 . . . . 10.0 110.634 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -94.06 125.62 46.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 4.5 t -107.64 148.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.904 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttt -59.56 138.18 57.78 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.119 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -51.56 -43.73 62.49 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.277 0.473 . . . . 10.0 112.277 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.84 -52.17 66.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.396 . . . . 10.0 111.51 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -65.79 -41.29 92.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.775 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.87 96.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.398 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 65.7 mt -62.6 -48.24 80.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.71 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 8.7 m -60.74 -41.16 94.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 36.4 m -67.59 -31.72 71.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.429 . . . . 10.0 110.561 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.79 -9.84 83.2 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.932 -0.651 . . . . 10.0 112.151 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -84.03 -17.97 38.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.055 0.455 . . . . 10.0 110.109 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.8 mt -80.3 157.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.674 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -73.34 78.1 1.36 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.201 0.524 . . . . 10.0 110.524 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.75 9.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.458 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 92.2 mmm -78.34 31.41 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.249 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mp -68.59 -26.12 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.158 0.504 . . . . 10.0 110.503 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 7.6 m -95.71 15.73 19.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.199 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.0 -61.31 3.8 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.378 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.82 166.61 15.6 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.713 2.275 . . . . 10.0 111.464 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.03 -66.64 2.71 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.31 -0.471 . . . . 10.0 113.551 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -126.05 120.9 31.45 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 122.39 -0.476 . . . . 10.0 111.415 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -95.65 90.96 5.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.35 166.6 22.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.702 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -63.8 -33.97 76.86 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -63.53 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.759 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -72.69 -24.0 60.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.432 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -80.3 -19.26 47.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.26 0.552 . . . . 10.0 109.929 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -94.09 -59.95 1.85 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.979 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -105.83 89.18 3.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.087 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 t -84.89 94.66 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.109 -178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -82.18 119.12 23.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.049 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -104.56 124.16 48.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.545 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -105.08 140.5 38.16 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.934 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 69.52 19.78 7.37 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.878 0.736 . . . . 10.0 111.011 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -127.04 107.5 21.92 Favored Pre-proline 0 C--O 1.236 0.389 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.98 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -64.97 158.75 49.82 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 123.269 2.646 . . . . 10.0 112.13 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -67.37 -41.52 84.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.266 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -57.41 8.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.518 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 32.4 m -65.56 -35.25 74.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.674 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -66.66 -34.69 78.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -60.16 -42.92 95.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.73 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 46.8 tttp -65.9 -35.18 79.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.458 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -44.57 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.736 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 54.8 m -61.18 -42.65 98.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.687 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.4 mtm -66.63 -38.91 87.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.726 179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -62.09 -43.84 97.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.587 179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -65.13 -43.35 92.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.262 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 75.3 m -57.85 -43.78 86.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.415 0.626 . . . . 10.0 109.584 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -67.07 -42.8 84.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.133 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -59.97 -39.12 84.53 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.232 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 56.0 t -59.4 -50.08 81.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.004 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.1 mmt180 -71.96 -37.24 69.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.653 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.03 -42.36 90.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.965 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.6 13.65 15.36 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.758 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -117.2 -56.34 2.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.331 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.12 -20.44 0.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 13.7 m -84.15 27.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.127 0.489 . . . . 10.0 111.512 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 -11.2 59.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.278 0.561 . . . . 10.0 110.128 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -77.42 -22.63 51.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.326 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 37.0 pt -100.37 165.88 13.63 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.031 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.11 171.2 16.38 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.306 2.004 . . . . 10.0 113.241 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.51 173.68 7.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.147 -0.933 . . . . 10.0 108.904 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -54.01 130.26 58.27 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.71 131.79 38.95 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.135 2.557 . . . . 10.0 112.914 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 16.7 pt -84.14 37.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.915 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -90.18 -54.58 0.29 Allowed Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.55 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -65.49 116.94 4.19 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.758 1.639 . . . . 10.0 111.681 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -69.58 -2.39 11.36 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.44 94.9 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.221 0.534 . . . . 10.0 110.452 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.51 -42.46 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.619 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.43 -24.85 64.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -63.27 -35.64 81.01 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.887 -1.051 . . . . 10.0 108.946 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 44.1 mt -78.97 -34.36 44.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.264 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 5.4 tt -64.46 -30.23 71.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.221 -0.9 . . . . 10.0 110.034 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 29.0 ttp -62.53 -18.16 61.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.44 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.56 83.06 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.593 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.94 -51.67 0.53 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.453 0.908 . . . . 10.0 113.453 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -78.81 13.54 1.66 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.878 0.371 . . . . 10.0 111.49 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.876 0 CA-C-O 118.786 -0.626 . . . . 10.0 109.435 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 CA-C-O 120.196 -0.224 . . . . 10.0 112.916 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -67.37 0.4 Allowed 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.871 0.323 . . . . 10.0 111.871 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.87 -34.79 78.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 10.0 110.392 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -52.45 -34.97 51.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.694 -0.685 . . . . 10.0 111.185 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -100.32 -40.77 7.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.566 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.18 -39.86 94.88 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.064 0.765 . . . . 10.0 113.064 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.31 -30.64 69.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.628 0.252 . . . . 10.0 111.382 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.4 -32.58 73.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.151 0.5 . . . . 10.0 110.192 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.65 56.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.553 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.04 -26.63 15.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -164.93 118.99 1.29 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.644 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.3 mt -86.02 97.03 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -113.29 97.01 41.65 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.186 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -88.22 59.14 2.88 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.854 2.369 . . . . 10.0 111.631 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -111.66 177.31 4.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.786 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -81.06 151.97 28.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.719 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mm -116.05 110.79 32.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.143 0.497 . . . . 10.0 111.351 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.87 137.38 30.43 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -32.7 137.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 124.27 3.313 . . . . 10.0 114.297 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.87 131.13 40.17 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.056 2.504 . . . . 10.0 112.217 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.72 123.21 89.08 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.643 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 -9.2 21.76 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.995 2.463 . . . . 10.0 111.876 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -31.63 72.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.103 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.0 t -134.78 -100.06 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.609 179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.1 ptp180 176.81 53.66 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.191 0.597 . . . . 10.0 110.594 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -149.52 149.19 30.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.45 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -72.4 159.6 33.72 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.931 0.396 . . . . 10.0 110.861 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.83 179.47 4.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.874 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -124.6 130.2 51.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.84 0.352 . . . . 10.0 111.129 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -168.37 -74.08 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.632 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.412 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.07 -56.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.851 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.621 -0.704 . . . . 10.0 110.261 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.7 tmm? . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 120.976 0.417 . . . . 10.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.0 143.29 31.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.346 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -127.49 118.31 49.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 120.992 0.425 . . . . 10.0 110.264 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -105.37 113.09 26.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.45 179.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.38 156.99 42.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.809 0.338 . . . . 10.0 111.354 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 64.6 mtm -125.21 108.37 11.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.529 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.4 mm -81.33 104.34 9.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.419 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -100.49 102.04 13.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 29.7 ttp85 -89.25 65.8 7.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-160 68.73 -77.94 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.145 -0.934 . . . . 10.0 110.645 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -108.54 -15.81 14.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.986 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -97.56 99.35 10.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.243 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -98.17 113.68 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.738 0.304 . . . . 10.0 110.561 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 51.5 mt -108.36 119.2 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.909 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -80.66 124.24 28.84 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.815 -0.439 . . . . 10.0 109.815 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.2 m -117.93 122.28 42.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.041 0.448 . . . . 10.0 112.093 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -104.47 99.25 8.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.818 -1.178 . . . . 10.0 107.818 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.55 -167.89 1.6 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.844 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -123.45 160.39 27.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.22 -26.72 67.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.956 0.408 . . . . 10.0 111.954 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.89 -10.75 59.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.983 -0.553 . . . . 10.0 112.062 -179.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 17.8 m -72.86 143.16 47.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -90.37 157.91 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.722 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -60.72 -36.75 73.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 10.0 111.165 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.9 -30.59 70.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.833 179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.18 -36.76 85.22 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.27 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.3 mt -61.23 -43.08 99.46 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.534 -0.543 . . . . 10.0 109.534 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.495 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 97.1 mttt -61.71 -38.52 88.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.168 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 61.9 mtp180 -65.87 -39.49 90.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.818 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 99.0 mt -65.96 -46.31 88.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.58 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 70.0 t -62.15 -38.1 80.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.753 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.54 -37.1 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.08 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.02 -4.35 77.53 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 120.972 -0.633 . . . . 10.0 112.895 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 84.4 mt -112.68 -54.03 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.725 0.298 . . . . 10.0 111.23 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.9 mt -82.39 -14.66 54.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.239 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 63.4 mttt 58.0 48.68 12.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.757 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -137.27 139.98 29.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.328 -0.851 . . . . 10.0 110.072 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -43.85 123.87 4.24 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.923 3.082 . . . . 10.0 113.665 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.4 -16.53 31.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.924 2.416 . . . . 10.0 111.848 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.69 -38.48 85.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.216 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -96.61 14.18 25.69 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.89 127.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -112.95 108.23 17.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.567 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.3 mt -90.71 112.37 24.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.087 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -108.06 117.38 34.0 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -132.23 138.33 47.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.301 -1.0 . . . . 10.0 108.301 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 63.39 27.98 15.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.446 0.466 . . . . 10.0 109.871 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 67.12 17.24 10.38 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.464 -0.789 . . . . 10.0 111.613 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -129.49 166.11 20.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.9 tp -89.91 130.54 36.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.577 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 82.9 mt -72.71 158.2 36.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.226 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -100.54 127.15 46.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.956 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.495 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 37.3 m-20 -66.24 -28.2 68.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.597 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.1 8.18 79.94 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.109 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.79 159.71 21.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.865 0.364 . . . . 10.0 110.817 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 28.2 p -92.06 170.47 9.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.45 99.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.79 -33.8 69.06 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.165 -0.54 . . . . 10.0 112.589 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -80.03 -13.64 59.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.678 0.275 . . . . 10.0 111.572 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 59.9 m -99.62 16.27 23.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.949 0.404 . . . . 10.0 111.633 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.17 11.85 77.62 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.728 -0.748 . . . . 10.0 113.199 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -86.84 96.86 10.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 117.061 0.431 . . . . 10.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 156.83 31.89 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 50.7 m -60.86 -22.28 64.1 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.183 0.438 . . . . 10.0 112.183 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -76.43 -37.36 57.14 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.812 0.301 . . . . 10.0 111.812 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -39.32 18.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.196 0.522 . . . . 10.0 109.674 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.56 82.1 1.99 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.283 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -89.67 157.76 46.22 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.029 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.28 -21.24 71.17 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.609 2.206 . . . . 10.0 111.819 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 4.05 23.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.794 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -155.83 80.23 4.05 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.613 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -74.7 144.83 31.92 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.889 2.392 . . . . 10.0 111.99 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 120.74 19.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.816 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.46 120.93 21.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.465 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 42.0 t -118.77 133.84 64.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.19 137.64 14.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.626 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.81 107.93 14.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.969 0.414 . . . . 10.0 111.578 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -103.55 138.83 39.7 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.183 -0.673 . . . . 10.0 109.183 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -114.79 121.75 44.25 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -74.57 82.87 2.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 10.0 111.849 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.21 122.32 43.97 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -66.01 145.88 55.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.338 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.93 24.79 14.74 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.875 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.3 m -132.09 112.34 12.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.207 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -69.82 -19.1 63.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.052 0.453 . . . . 10.0 111.198 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -54.64 -33.2 60.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.217 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.55 -30.26 69.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.769 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 14.0 mt -92.18 -9.92 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.316 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 43.0 m -87.23 -35.62 18.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.917 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mt -89.54 14.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.234 0.54 . . . . 10.0 110.825 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.94 103.85 46.41 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -67.97 -3.86 11.36 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.338 2.692 . . . . 10.0 112.054 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -75.65 -27.62 58.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.998 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 68.7 m -124.31 -35.56 2.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.239 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 58.8 m -103.42 151.54 38.65 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.419 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.49 157.84 32.56 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.553 2.169 . . . . 10.0 111.441 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 132.87 31.43 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.268 1.979 . . . . 10.0 111.4 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -68.67 108.97 3.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.069 0.462 . . . . 10.0 111.424 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 19.2 tp -138.57 125.43 13.05 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.35 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.75 135.01 57.25 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.81 2.34 . . . . 10.0 112.698 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.34 -38.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.971 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 m -68.24 -18.2 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.236 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 93.8 mmm -115.45 51.03 0.95 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.468 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -119.38 -53.87 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.77 67.62 7.32 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.499 2.133 . . . . 10.0 111.903 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -133.4 162.15 32.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.517 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -79.91 178.03 8.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.021 0.438 . . . . 10.0 111.356 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.88 131.13 43.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.25 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.68 -153.37 15.46 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.95 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.36 -29.77 17.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.098 0.475 . . . . 10.0 110.739 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 19.4 m -93.74 159.68 15.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.83 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.85 134.22 48.24 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.347 -0.982 . . . . 10.0 108.347 178.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.03 -5.96 2.08 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.566 0.541 . . . . 10.0 111.46 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -74.16 127.34 32.7 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.845 0.355 . . . . 10.0 110.466 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -109.69 139.8 44.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -99.62 101.93 13.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.361 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -70.5 109.24 2.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.101 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.445 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.699 0.285 . . . . 10.0 110.985 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -101.68 105.43 16.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 36.5 mt -91.1 113.44 25.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.808 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 33.3 mt -100.6 119.4 48.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -93.09 166.24 12.44 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.673 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -16.97 44.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -85.67 -3.77 58.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.799 0.333 . . . . 10.0 110.729 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.59 18.28 60.45 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.584 -0.817 . . . . 10.0 112.713 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 135.9 33.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -104.65 113.23 26.67 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.999 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.87 113.02 26.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.692 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 22.3 mm -98.82 117.91 44.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -103.83 137.97 30.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.544 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -60.02 134.44 57.05 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -51.69 -43.6 62.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.854 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -51.89 -51.61 55.6 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.96 0.41 . . . . 10.0 111.744 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -74.22 -37.28 63.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.332 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.63 95.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.479 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.74 -49.6 77.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.815 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -63.15 -36.61 84.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.981 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.2 m -67.16 -33.14 74.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 10.0 110.407 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.1 -11.69 84.65 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.398 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 -18.26 47.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 10.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -83.75 160.53 3.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.394 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -73.74 86.43 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.136 0.493 . . . . 10.0 111.059 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -99.24 173.44 6.79 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.829 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.0 mmm -78.58 31.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.873 0.323 . . . . 10.0 111.873 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 tp -65.25 -31.99 73.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.568 . . . . 10.0 109.809 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.5 14.19 19.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.466 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.6 -60.29 5.51 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.865 -0.607 . . . . 10.0 113.185 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.91 179.76 2.56 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.345 2.03 . . . . 10.0 112.461 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.21 -55.44 18.7 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.289 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -142.13 121.29 12.99 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.784 -0.245 . . . . 10.0 110.824 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.91 91.24 5.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.6 159.83 26.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.047 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -60.58 -25.37 66.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.497 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.2 -35.1 71.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.073 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.05 -28.77 64.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.388 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.02 -16.11 60.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -85.12 -52.38 5.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.385 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -129.56 99.06 5.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.376 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -83.52 114.72 24.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.628 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -90.33 109.11 20.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.869 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -106.76 94.47 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 10.0 111.374 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -89.89 156.71 18.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 70.95 16.6 6.47 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.234 0.54 . . . . 10.0 111.305 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 75.8 mt -130.15 117.94 18.19 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.708 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -65.55 138.83 56.13 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.791 2.327 . . . . 10.0 111.806 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -59.95 -40.85 90.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -50.04 61.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.902 -0.59 . . . . 10.0 112.392 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.0 m -73.87 -27.4 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 120.942 -0.303 . . . . 10.0 111.593 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.86 -39.36 93.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.512 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -35.34 72.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.86 0.362 . . . . 10.0 110.791 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.14 -35.11 77.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.116 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.0 t -67.24 -47.44 81.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 35.9 m -59.56 -40.53 87.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.462 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -65.69 -42.51 91.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.849 179.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -65.44 -40.58 93.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.817 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -61.7 -47.34 85.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.925 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.5 m -60.58 -42.21 96.23 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.972 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -62.86 -42.53 99.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.325 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -64.13 -37.54 87.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.167 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.82 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.006 0.431 . . . . 10.0 110.089 179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -72.79 -42.31 64.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.185 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -57.25 -48.44 78.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.662 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 50.06 1.7 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.208 0.528 . . . . 10.0 110.771 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -162.16 -58.44 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.297 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -130.1 -36.92 1.5 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.981 0.42 . . . . 10.0 111.647 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 11.2 m -83.9 37.22 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.68 8.09 23.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.5 0.667 . . . . 10.0 109.694 179.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -99.52 -2.34 36.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.523 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 42.1 pt -115.91 166.54 12.09 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.57 172.36 16.47 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.371 2.047 . . . . 10.0 112.718 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.56 170.32 9.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.036 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -53.94 130.63 57.96 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.766 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.07 118.62 5.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.994 2.463 . . . . 10.0 112.197 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 pt -81.18 42.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.657 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.32 -59.47 0.25 Allowed Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.09 111.16 3.11 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.707 1.604 . . . . 10.0 111.365 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.52 56.37 2.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.681 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 3.9 mm -120.08 9.8 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.465 0.65 . . . . 10.0 110.549 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.28 -26.03 22.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.095 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 15.6 tp -70.87 -27.58 63.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.069 0.461 . . . . 10.0 109.816 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -61.39 -31.65 71.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.668 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -77.5 -35.99 53.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.349 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.2 -23.81 65.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.579 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 38.6 ttp -57.49 -26.95 62.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.27 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.59 -30.85 71.64 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.57 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.87 -65.54 0.28 Allowed 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -82.9 36.56 0.5 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.352 0.501 . . . . 10.0 112.352 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.128 179.241 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.685 -0.166 . . . . 10.0 112.685 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -63.74 1.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -179.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 tp -62.74 -27.93 69.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.501 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -58.98 -26.86 64.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.349 0.595 . . . . 10.0 110.765 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -105.01 -38.73 6.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.199 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.86 -38.8 92.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.406 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.33 84.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.682 0.277 . . . . 10.0 110.802 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 tp -67.49 -27.73 67.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.366 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.02 -17.98 44.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.157 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.8 -48.83 6.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.603 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -149.8 124.63 9.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.407 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -95.73 93.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.112 -0.699 . . . . 10.0 109.112 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -98.01 116.75 65.61 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.226 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -90.83 38.18 0.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.951 2.434 . . . . 10.0 111.972 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -94.95 166.58 11.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.237 179.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -79.03 154.84 29.15 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.3 mm -118.41 105.93 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.06 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.5 tttp -122.75 143.46 40.25 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -29.6 130.07 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 124.557 3.505 . . . . 10.0 114.326 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.34 135.4 67.73 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.393 2.729 . . . . 10.0 113.026 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.66 128.33 85.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.839 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -68.95 -13.62 37.02 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.099 2.533 . . . . 10.0 112.986 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.06 -35.67 80.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.974 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -129.78 -122.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.995 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -160.2 58.09 0.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.19 0.519 . . . . 10.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -152.31 154.56 35.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.682 -0.69 . . . . 10.0 109.256 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -77.69 152.78 33.57 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.744 0.306 . . . . 10.0 110.536 179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.5 m -87.34 149.22 24.65 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.231 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -105.11 99.71 9.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.851 0.358 . . . . 10.0 110.285 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -149.78 -74.76 0.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.148 -0.478 . . . . 10.0 109.959 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.431 ' C ' ' HE ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.69 -68.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 179.002 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.3 m0 . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.255 179.342 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.051 0.453 . . . . 10.0 110.334 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.51 132.36 35.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.707 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.5 t -121.4 116.57 50.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.707 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -107.35 113.24 26.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.01 158.4 38.0 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.866 0.365 . . . . 10.0 111.323 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 57.3 mtm -128.51 109.25 11.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.642 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mm -83.51 110.14 17.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -107.86 108.1 19.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -91.69 71.48 5.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.593 -1.262 . . . . 10.0 107.593 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 67.19 -77.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.482 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -110.27 -7.61 14.82 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -106.36 104.49 14.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.519 0.2 . . . . 10.0 111.394 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.5 m -101.04 118.08 36.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.783 0.325 . . . . 10.0 110.568 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -110.86 123.85 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.743 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -81.08 125.17 29.87 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.6 m -118.07 119.2 34.03 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.161 0.505 . . . . 10.0 111.6 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -104.91 101.55 11.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.318 -0.993 . . . . 10.0 108.318 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.72 -171.2 2.32 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.89 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -124.35 162.41 23.86 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -61.11 -22.94 65.13 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.345 0.498 . . . . 10.0 112.345 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -2.07 47.04 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -91.88 144.54 25.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.531 0.205 . . . . 10.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 32.3 p -93.31 167.31 11.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.078 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 75.5 t -66.3 -34.54 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.865 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -62.14 -36.37 81.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 10.0 110.357 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.66 -33.2 75.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.835 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -63.39 -45.95 88.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 10.0 109.928 179.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.52 -32.54 73.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.529 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -64.79 -37.46 87.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.037 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -69.01 -44.48 81.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.44 -33.64 57.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.482 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -34.22 72.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.96 -0.563 . . . . 10.0 111.058 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.7 -19.29 58.39 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.542 -0.837 . . . . 10.0 112.844 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.7 mt -89.24 -57.91 3.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 10.0 111.66 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 39.8 mt -91.86 -8.12 47.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.854 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 mttt 58.78 51.2 7.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.368 0.604 . . . . 10.0 110.817 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -125.02 133.65 25.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.052 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.37 125.57 19.25 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.928 2.418 . . . . 10.0 112.294 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.69 -21.84 73.04 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.225 2.616 . . . . 10.0 113.059 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -64.39 -33.23 75.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.1 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -94.14 -2.77 52.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.059 -179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -82.64 126.85 32.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.54 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 86.7 mmt-85 -120.02 110.86 17.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 54.0 mt -92.86 118.08 30.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.905 0.383 . . . . 10.0 111.062 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -112.98 117.57 32.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.724 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -128.99 137.69 51.5 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.317 -0.994 . . . . 10.0 108.317 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 66.28 27.25 10.21 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.514 0.509 . . . . 10.0 109.749 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 67.89 17.07 9.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.773 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -132.12 169.79 15.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 41.7 tp -85.24 135.07 34.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.955 0.407 . . . . 10.0 111.202 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 65.2 mt -79.0 150.23 32.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.532 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.19 113.64 25.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.0 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.02 -28.01 64.08 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.651 0.611 . . . . 10.0 112.651 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.64 -11.62 68.16 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.425 -178.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -95.29 153.74 17.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.968 0.413 . . . . 10.0 110.796 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 32.6 p -83.37 165.54 19.18 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.23 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.35 -44.73 88.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.486 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.16 -33.07 64.04 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.451 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.57 -29.57 52.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.946 0.403 . . . . 10.0 111.086 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 36.9 m -83.58 14.37 3.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 111.696 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 81.66 12.35 81.72 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 121.081 -0.581 . . . . 10.0 112.905 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -87.79 85.7 7.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.003 0.43 . . . . 10.0 110.321 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 47.1 p -114.42 165.23 12.95 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.435 -0.58 . . . . 10.0 109.435 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 9.7 m -65.54 -5.15 7.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.897 0.379 . . . . 10.0 111.971 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -81.8 -46.35 14.31 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.233 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.31 -35.14 18.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.937 179.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -101.35 93.31 5.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.275 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -109.43 157.84 36.23 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.666 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.61 -17.17 58.7 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.402 2.068 . . . . 10.0 111.518 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.13 -5.76 21.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.507 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -157.54 89.48 2.44 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.723 -179.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -79.14 138.29 14.19 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.966 2.444 . . . . 10.0 111.941 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.67 117.45 8.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.533 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -80.1 125.59 30.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.086 0.47 . . . . 10.0 111.672 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 32.0 t -119.3 139.27 47.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.456 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.18 131.25 10.54 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.582 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -109.64 99.36 8.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.873 0.368 . . . . 10.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.51 113.42 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -96.05 117.35 30.5 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.64 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -71.87 91.57 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.224 0.535 . . . . 10.0 111.221 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -99.64 129.96 45.83 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.19 129.88 41.7 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.38 19.86 11.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.624 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.0 m -117.08 112.96 21.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.853 0.359 . . . . 10.0 110.127 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -74.09 -6.37 47.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.127 0.788 . . . . 10.0 113.127 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -62.91 -32.6 73.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.935 0.398 . . . . 10.0 111.341 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.95 -37.45 74.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.89 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.25 -15.27 61.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.928 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.92 -26.06 17.77 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 mt -84.11 -11.82 11.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 10.0 110.982 -179.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -85.67 113.36 50.74 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.847 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.68 -14.94 45.91 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.047 2.498 . . . . 10.0 111.827 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -74.0 -37.38 64.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.262 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -96.67 -44.86 6.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.817 0.341 . . . . 10.0 111.021 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.9 m -111.45 138.98 21.57 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.657 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.04 153.75 76.77 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.386 2.057 . . . . 10.0 111.519 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -52.51 126.85 22.07 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.036 2.491 . . . . 10.0 112.575 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -70.31 107.29 3.69 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.259 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.0 tp -138.77 126.74 13.64 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.91 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.13 127.01 21.74 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.589 2.193 . . . . 10.0 111.778 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.66 -31.26 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.735 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 20.7 m -67.5 -14.67 18.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.683 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 79.9 mmm -114.51 10.69 16.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.129 0.49 . . . . 10.0 109.873 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -78.27 -53.42 1.35 Allowed Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 112.834 0.679 . . . . 10.0 112.834 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.93 71.43 6.2 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.474 2.116 . . . . 10.0 112.356 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -135.73 167.73 20.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.0 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.62 159.3 19.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.944 0.402 . . . . 10.0 111.735 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -82.82 138.22 34.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -93.64 -174.7 39.97 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 121.085 -0.578 . . . . 10.0 112.312 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -33.18 67.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.992 0.425 . . . . 10.0 111.546 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.25 159.55 20.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.166 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.56 121.73 15.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.332 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.28 13.53 6.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.921 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -73.36 128.66 36.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -106.4 130.42 54.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.799 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.97 107.81 16.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.352 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -72.05 126.7 33.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.085 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.3 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.022 0.439 . . . . 10.0 110.775 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -110.57 119.0 37.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.742 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 43.2 mt -99.92 129.83 46.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.058 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 37.4 mt -113.5 119.91 62.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.7 p -89.64 168.36 12.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.178 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -69.15 -16.57 63.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.825 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -81.05 -16.71 52.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.94 0.4 . . . . 10.0 110.542 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 98.7 13.25 41.32 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.409 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -90.82 130.37 36.79 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.821 -0.436 . . . . 10.0 109.821 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -98.7 134.3 41.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.106 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -124.31 123.25 39.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.675 0.274 . . . . 10.0 111.29 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 33.2 mm -102.14 114.56 41.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 t -97.63 141.43 15.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.414 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -61.8 121.97 14.2 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -51.36 -39.91 58.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.764 0.653 . . . . 10.0 112.764 -178.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -58.37 -52.37 65.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.809 0.337 . . . . 10.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -68.46 -33.01 73.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.091 0.472 . . . . 10.0 110.49 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.82 88.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.688 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.67 -45.28 94.7 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.883 -0.414 . . . . 10.0 109.883 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.45 -38.64 91.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.975 178.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -65.53 -36.78 84.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.286 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.72 -8.49 81.77 Favored Glycine 0 C--N 1.33 0.209 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.334 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 18.7 m -81.36 -20.96 39.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.393 0.616 . . . . 10.0 109.578 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.7 mt -84.06 159.03 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.175 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -76.11 81.19 2.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.143 0.497 . . . . 10.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.28 -163.19 0.85 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.876 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 83.9 mmm -101.76 27.39 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.64 -0.254 . . . . 10.0 111.453 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.91 -36.45 84.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.265 0.555 . . . . 10.0 110.495 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.2 m -91.58 14.32 15.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.397 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -57.75 4.94 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-N 115.823 -0.626 . . . . 10.0 113.16 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.44 -160.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.686 2.258 . . . . 10.0 111.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.37 -110.64 0.16 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.78 -0.724 . . . . 10.0 112.285 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -86.69 123.97 32.44 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 122.753 -0.263 . . . . 10.0 110.612 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -101.25 74.99 1.6 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.005 0.431 . . . . 10.0 110.105 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.15 158.44 33.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.335 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.03 -27.77 63.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.03 -35.82 77.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.02 0.438 . . . . 10.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -84.87 -21.7 29.66 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.74 -0.663 . . . . 10.0 109.824 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.1 m -77.72 -40.11 42.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.517 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -68.0 -47.31 68.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.862 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -124.82 90.43 3.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.18 115.63 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.886 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -91.98 111.96 23.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.917 0.389 . . . . 10.0 110.804 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -97.36 114.85 26.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.112 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -100.11 147.13 26.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.221 -0.445 . . . . 10.0 109.887 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 65.52 21.41 11.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.749 0.655 . . . . 10.0 110.839 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 90.0 mt -129.59 109.49 17.42 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-O 121.079 0.466 . . . . 10.0 111.131 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -63.77 150.98 87.17 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.135 2.557 . . . . 10.0 112.13 179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.2 p -64.99 -38.96 92.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.411 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -54.24 46.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.78 -0.645 . . . . 10.0 112.294 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 m -67.81 -34.62 68.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.638 -0.255 . . . . 10.0 111.334 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.53 -37.93 89.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.62 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -58.05 -40.71 81.62 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.543 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -67.55 -35.59 79.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.567 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 59.4 t -64.26 -46.49 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.847 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.4 m -60.66 -39.49 88.58 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.158 -0.473 . . . . 10.0 110.628 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 52.6 mtm -67.29 -41.45 85.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.334 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -62.11 -42.87 99.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.49 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.49 -47.2 86.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.266 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -61.06 -42.45 98.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.161 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.18 -44.82 90.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.078 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . 0.445 ' HZ3' ' CD ' ' C' ' 74' ' ' GLU . 27.6 tptt -59.93 -42.14 93.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.612 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 51.3 t -59.12 -50.94 77.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.313 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -66.9 -42.33 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.733 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.8 -43.75 85.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.231 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 15.88 14.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.115 0.484 . . . . 10.0 111.18 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.93 -59.24 2.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.173 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.43 -30.14 0.56 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.389 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 10.4 m -80.82 47.58 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.941 0.4 . . . . 10.0 111.59 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.56 4.61 53.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.602 0.715 . . . . 10.0 110.018 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -80.83 -26.03 37.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.05 -0.977 . . . . 10.0 109.656 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.15 167.28 12.69 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.787 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -80.34 179.88 5.78 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.276 1.984 . . . . 10.0 112.574 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . 0.445 ' CD ' ' HZ3' ' C' ' 62' ' ' LYS . 9.6 tp10 -69.65 168.64 14.42 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.651 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -48.23 127.57 12.41 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 122.382 0.273 . . . . 10.0 111.624 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -48.46 128.15 17.26 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.657 2.905 . . . . 10.0 113.614 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 13.2 pt -83.08 50.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.383 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.2 -57.59 0.13 Allowed Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.9 120.13 6.95 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.605 1.537 . . . . 10.0 111.098 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -71.44 -8.18 52.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mm -79.54 83.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.491 0.662 . . . . 10.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 -41.98 0.16 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.867 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 11.8 tp -68.1 -25.57 65.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.506 -0.77 . . . . 10.0 108.981 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 20.9 mp0 -61.17 -36.14 79.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.64 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 38.5 mt -74.56 -33.57 62.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.838 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.171 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 28.0 ttp -60.48 -20.98 61.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.672 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.02 -30.56 71.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.449 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.14 -61.68 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.4 41.74 0.63 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.251 0.548 . . . . 10.0 111.369 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.823 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.194 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.406 -0.278 . . . . 10.0 112.406 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -61.26 2.5 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.89 -28.76 70.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.231 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -55.99 -29.7 60.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.489 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -104.89 -34.63 7.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.979 0.418 . . . . 10.0 110.661 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -40.82 97.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 10.0 112.0 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.22 68.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.773 0.321 . . . . 10.0 111.058 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 tp -66.04 -34.88 79.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.332 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.74 -13.44 56.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.543 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.34 -42.11 13.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.239 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -158.95 116.77 2.84 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.24 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.5 mt -85.58 88.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 178.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -97.62 103.7 17.64 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.737 -179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -91.57 72.73 0.8 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.248 2.632 . . . . 10.0 111.452 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -131.68 169.71 15.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.497 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -85.09 149.04 25.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.697 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mm -102.02 129.53 53.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.202 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.04 145.16 54.55 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.228 -1.027 . . . . 10.0 108.228 178.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -36.14 131.05 0.36 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.693 2.928 . . . . 10.0 112.678 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -54.89 152.64 28.22 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 123.401 2.734 . . . . 10.0 113.233 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 mt -74.44 117.99 66.4 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.837 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.15 -23.54 52.8 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.726 2.284 . . . . 10.0 112.287 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.26 61.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.63 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.3 t -108.07 -132.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.27 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -158.49 56.29 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 10.0 110.525 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttm -152.09 149.75 29.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.334 -0.848 . . . . 10.0 108.876 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.07 154.52 40.39 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.715 0.293 . . . . 10.0 111.108 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 m -93.29 165.7 12.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.162 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -113.62 127.74 56.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.592 0.234 . . . . 10.0 110.629 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -172.19 -79.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.795 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.84 -54.44 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 . . . . . 0 C--O 1.247 0.961 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.081 179.944 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmm? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 120.572 0.225 . . . . 10.0 111.482 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.15 115.5 1.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.75 122.11 63.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.272 0.558 . . . . 10.0 111.318 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -108.13 105.25 14.9 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.629 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.31 150.4 32.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.031 0.443 . . . . 10.0 111.499 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 38.5 ttm -120.91 101.36 7.64 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.47 -179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.5 mm -80.94 113.56 20.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -111.63 101.87 10.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -89.75 73.63 7.56 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 65.09 -81.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.529 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -114.76 0.37 13.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.787 0.327 . . . . 10.0 111.603 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.7 m -106.72 100.03 9.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.158 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 50.2 m -93.89 127.51 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.866 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.35 117.34 51.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.305 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -82.69 119.01 23.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -113.65 113.01 24.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.203 0.525 . . . . 10.0 112.16 -179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 99.79 10.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.581 -1.266 . . . . 10.0 107.581 178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.8 -166.18 1.56 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.517 -0.311 . . . . 10.0 111.288 -178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -128.03 158.21 38.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.842 -0.429 . . . . 10.0 109.842 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -56.78 -31.03 64.24 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.365 0.505 . . . . 10.0 112.365 -179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -17.38 64.68 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 49.5 m -79.43 142.59 35.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.71 0.29 . . . . 10.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 25.2 p -90.47 167.11 12.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.798 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.3 t -65.12 -32.59 58.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.014 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.01 -38.07 89.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.064 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.95 -31.18 72.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.935 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.85 -42.22 95.07 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.437 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 97.4 mttt -61.58 -36.12 79.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.648 -0.706 . . . . 10.0 110.245 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.03 -37.61 87.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.2 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -69.28 -47.8 71.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.538 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.23 -39.4 80.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.638 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -58.79 -38.29 78.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.377 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.25 -11.83 84.65 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.809 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 72.3 mt -103.22 -51.51 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.865 0.364 . . . . 10.0 111.474 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 41.2 mt -84.25 -16.0 44.79 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.494 0.553 . . . . 10.0 112.494 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 mttt 62.05 45.45 7.23 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.531 0.681 . . . . 10.0 110.609 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.4 mtt-85 -133.3 143.66 49.13 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.529 -0.76 . . . . 10.0 109.972 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.79 131.6 46.59 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.12 2.547 . . . . 10.0 112.755 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.05 -16.68 36.4 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.872 2.381 . . . . 10.0 112.036 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.64 -28.21 69.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.434 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -104.93 13.34 31.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.82 0.343 . . . . 10.0 111.812 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -92.48 127.68 38.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.865 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 43.1 mmt-85 -117.37 111.76 19.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.416 -0.357 . . . . 10.0 110.616 179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.1 mt -95.97 113.64 25.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.556 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -109.45 115.96 30.92 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.236 0.541 . . . . 10.0 112.435 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -115.43 127.27 55.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.404 -0.816 . . . . 10.0 108.919 178.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 61.91 35.87 16.11 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.51 0.506 . . . . 10.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.15 9.11 7.21 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.394 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -119.7 160.33 22.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.142 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 tp -85.66 139.0 31.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.644 0.259 . . . . 10.0 110.882 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -79.51 170.72 16.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.882 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -112.88 120.47 41.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.945 0.402 . . . . 10.0 110.754 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.437 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 0.9 OUTLIER -64.04 -25.99 68.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.297 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.88 13.33 66.29 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.813 -0.708 . . . . 10.0 113.179 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.77 155.17 43.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.034 0.445 . . . . 10.0 111.349 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 24.8 p -87.25 168.58 13.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.166 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 51.3 mt -60.79 -39.66 89.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.838 0.351 . . . . 10.0 110.654 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.8 -27.71 67.09 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.851 -0.613 . . . . 10.0 112.623 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.0 -26.56 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.061 0.457 . . . . 10.0 110.782 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.0 m -82.46 2.78 31.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.846 -0.615 . . . . 10.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.22 15.95 59.88 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.906 -0.664 . . . . 10.0 113.018 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -86.61 87.39 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.818 0.342 . . . . 10.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.2 p -108.8 170.26 8.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 33.9 m -70.62 -3.78 19.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.079 0.466 . . . . 10.0 111.113 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -88.36 -43.17 11.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -79.05 -30.45 44.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.073 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -118.41 106.57 12.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.03 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -113.01 160.08 32.26 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.806 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.85 -24.47 47.43 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.987 2.458 . . . . 10.0 113.025 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.55 12.97 16.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.707 0.289 . . . . 10.0 111.351 179.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -152.83 82.71 4.94 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.741 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.03 133.02 14.65 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.884 2.389 . . . . 10.0 111.726 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 114.7 5.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.41 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.56 125.1 26.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.11 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.06 131.01 73.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.27 133.26 11.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.617 -0.801 . . . . 10.0 111.625 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.2 tp -114.7 108.51 16.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.0 0.429 . . . . 10.0 111.453 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -102.2 141.01 35.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.001 -0.741 . . . . 10.0 109.001 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -119.56 121.63 39.79 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -76.19 96.85 3.99 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.274 0.559 . . . . 10.0 111.456 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -115.43 120.89 41.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.224 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -57.93 132.5 53.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.962 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.28 4.34 4.5 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.369 -0.832 . . . . 10.0 112.693 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 108.79 20.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.11 0.481 . . . . 10.0 110.031 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -82.73 -7.98 59.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.804 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.45 -29.36 66.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.321 179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.8 -38.96 79.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.446 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.04 -27.9 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.539 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 35.0 m -77.14 -26.94 53.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.955 0.407 . . . . 10.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.0 mt -88.2 -21.16 7.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.45 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -76.23 112.56 21.61 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.92 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.63 -7.85 22.01 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.043 2.495 . . . . 10.0 111.959 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.57 -19.13 46.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.163 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -121.39 -35.81 3.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.082 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 8.9 m -119.58 143.71 35.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.106 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.19 142.84 47.05 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.326 2.018 . . . . 10.0 111.143 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.82 128.4 21.48 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.182 2.588 . . . . 10.0 112.625 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -65.9 111.67 3.41 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 tp -137.42 134.91 18.82 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.509 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.87 131.09 26.27 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.867 2.378 . . . . 10.0 112.17 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -69.67 -29.69 67.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.092 0.472 . . . . 10.0 110.577 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.6 m -71.52 -13.01 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.192 0.52 . . . . 10.0 110.76 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 83.9 mmm -116.56 17.58 15.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.781 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -85.25 -54.28 0.44 Allowed Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 112.796 0.665 . . . . 10.0 112.796 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -74.15 73.18 3.87 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.208 1.939 . . . . 10.0 111.747 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -139.61 162.39 35.21 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.25 167.75 15.36 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.874 0.368 . . . . 10.0 111.804 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 131.91 34.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.258 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.38 -154.99 23.92 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.902 -0.665 . . . . 10.0 112.552 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.32 -32.63 17.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.978 0.418 . . . . 10.0 111.149 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 36.2 m -89.11 163.73 15.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.371 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.71 129.13 38.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 68.85 15.18 8.95 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.645 0.591 . . . . 10.0 111.62 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -81.58 121.64 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -103.12 132.91 49.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.828 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.72 109.0 19.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.6 t -78.61 128.36 38.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 10.0 111.68 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.766 0.317 . . . . 10.0 111.446 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -123.08 113.63 19.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.382 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 28.2 mt -83.84 133.3 34.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.167 -0.47 . . . . 10.0 109.845 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.2 mt -117.92 108.82 25.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.2 p -83.61 166.47 18.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.061 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -14.49 60.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 10.0 111.755 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -86.29 -2.64 58.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 10.0 110.604 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.8 23.8 59.24 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.006 -0.616 . . . . 10.0 111.922 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.85 127.58 44.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -94.26 136.49 34.49 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.796 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -123.92 102.5 7.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.873 0.368 . . . . 10.0 111.207 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 mm -87.15 115.04 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 179.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.4 t -102.82 139.24 24.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.291 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 49.0 tttt -62.38 133.57 55.24 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -55.34 -35.86 65.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.869 -179.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -54.04 -44.21 70.82 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.102 0.477 . . . . 10.0 110.953 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -81.16 -43.08 19.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.622 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.11 74.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.361 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.81 -41.06 96.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.86 0.362 . . . . 10.0 110.765 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -65.64 -48.23 72.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 12.3 m -61.01 -33.73 73.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.859 0.362 . . . . 10.0 110.873 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.09 -9.4 71.62 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.052 -0.594 . . . . 10.0 112.345 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 6.0 m -99.44 2.16 44.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.515 0.674 . . . . 10.0 110.052 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.66 160.48 5.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -64.95 101.27 0.48 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 10.0 111.144 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.76 166.92 13.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.161 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 53.6 mmm -76.86 34.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mp -71.61 -25.19 62.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.119 0.485 . . . . 10.0 110.361 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -94.0 16.71 13.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.384 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.74 -56.88 2.53 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.42 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -62.03 166.98 11.39 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.602 2.202 . . . . 10.0 112.706 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.53 92.81 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.887 -0.597 . . . . 10.0 113.069 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -152.93 114.79 4.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.81 0.338 . . . . 10.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -82.31 79.74 8.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.842 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.28 163.06 28.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.273 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -59.67 -19.5 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -64.22 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.31 -20.33 63.88 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.547 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.7 m -74.53 -30.77 61.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.02 0.438 . . . . 10.0 110.647 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -94.06 -55.78 3.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.22 92.95 4.27 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.6 t -85.82 97.01 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.172 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -84.09 111.65 19.51 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.927 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -115.72 109.94 18.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -96.74 163.45 12.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.191 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 69.53 7.17 6.09 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.525 0.516 . . . . 10.0 111.72 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 60.1 mt -122.76 106.22 34.71 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.121 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -58.6 145.02 96.76 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.874 2.383 . . . . 10.0 112.024 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.7 p -58.35 -41.29 84.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.503 -179.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.95 -55.64 28.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.917 -0.583 . . . . 10.0 112.361 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.6 m -67.62 -34.41 67.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 121.077 -0.249 . . . . 10.0 111.61 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.08 -33.51 75.93 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 39.2 m -61.89 -39.75 93.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.403 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -65.68 -37.67 87.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.314 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 55.2 t -63.99 -44.88 97.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.575 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.3 m -61.18 -39.65 90.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.649 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.9 mtm -68.29 -38.04 81.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.35 -44.11 95.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.76 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.44 -42.92 98.67 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 78.9 m -59.05 -43.75 91.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.839 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.29 -43.6 85.88 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.496 179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -60.87 -41.17 95.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.666 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 50.5 t -57.58 -47.14 85.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 10.0 110.392 179.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -75.11 -40.44 59.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.707 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -58.83 -43.39 90.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.66 -179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.79 18.79 4.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.148 0.499 . . . . 10.0 111.111 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -123.75 -68.82 0.85 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.028 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.48 -23.29 4.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.969 0.414 . . . . 10.0 111.842 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 12.3 m -84.46 27.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.207 0.527 . . . . 10.0 111.808 -179.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -0.32 40.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.26 0.552 . . . . 10.0 110.606 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.86 -17.21 33.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.803 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 33.4 pt -103.44 163.3 17.71 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.836 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -69.16 168.91 19.41 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.928 2.419 . . . . 10.0 112.403 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -70.05 166.87 18.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.082 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -52.12 130.01 40.56 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.859 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -58.49 124.14 15.17 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.809 2.339 . . . . 10.0 112.115 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 11.1 pt -78.19 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.341 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.85 -55.84 0.16 Allowed Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -68.41 103.71 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.25 1.967 . . . . 10.0 111.483 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -74.58 58.68 0.79 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.511 0.559 . . . . 10.0 112.511 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 14.8 mm -122.2 -4.73 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.187 0.517 . . . . 10.0 110.796 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.62 74.82 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.155 -0.34 . . . . 10.0 111.582 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 19.3 tp -68.21 -33.2 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -63.01 -36.51 83.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.219 -0.9 . . . . 10.0 109.663 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 76.6 mt -74.39 -34.14 63.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.425 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.26 -17.3 64.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.83 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.0 ttp -63.67 -18.27 63.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.793 179.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.51 75.99 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.477 -0.564 . . . . 10.0 109.477 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.71 -68.49 0.14 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.373 -0.831 . . . . 10.0 112.962 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -80.85 47.52 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.345 0.593 . . . . 10.0 111.266 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 10.6 t80 . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 179.695 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 N-CA-C 111.92 -0.472 . . . . 10.0 111.92 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -62.49 1.78 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.24 -31.03 72.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.606 -178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -54.65 -36.45 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.066 0.46 . . . . 10.0 110.972 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -93.45 -39.97 10.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.453 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.42 -29.56 70.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.684 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.27 -40.95 98.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.795 0.331 . . . . 10.0 110.984 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.4 tp -68.04 -31.87 71.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.206 0.527 . . . . 10.0 109.83 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.12 15.71 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.448 -0.796 . . . . 10.0 110.3 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.78 -39.27 2.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.952 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.94 122.6 1.61 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.906 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.3 mt -89.15 87.51 2.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.3 tttt -100.85 111.33 63.01 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.286 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.96 45.11 0.09 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.332 2.688 . . . . 10.0 111.595 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -95.27 175.77 6.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.131 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.36 152.43 27.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.1 0.476 . . . . 10.0 111.52 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.8 mm -113.51 141.82 28.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.879 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -160.65 144.59 10.26 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -38.5 136.04 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.331 2.687 . . . . 10.0 112.88 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.11 134.53 53.23 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 123.119 2.546 . . . . 10.0 112.82 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.24 123.32 87.92 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.254 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.26 -12.72 36.15 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 123.087 2.525 . . . . 10.0 113.074 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -39.54 94.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.122 0.487 . . . . 10.0 110.124 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.2 t -126.82 -118.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.91 63.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.525 . . . . 10.0 110.476 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -157.36 153.28 27.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.241 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 pp -74.14 148.23 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.736 0.303 . . . . 10.0 110.534 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 m -81.45 163.87 22.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.254 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -111.72 102.22 10.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.748 0.308 . . . . 10.0 110.513 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -150.67 -82.34 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.301 -0.408 . . . . 10.0 110.613 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.42 ' C ' ' HE ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.36 -54.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.65 -0.691 . . . . 10.0 109.74 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tmm? . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 121.013 0.435 . . . . 10.0 110.774 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.56 146.67 30.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.813 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 84.7 t -131.59 118.78 40.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 121.121 0.486 . . . . 10.0 111.362 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -108.68 113.86 27.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.94 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.16 159.43 36.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.829 0.347 . . . . 10.0 111.581 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 60.9 mtm -127.01 109.02 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.845 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.5 mm -81.69 103.23 8.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -101.34 110.94 23.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.382 0.882 . . . . 10.0 113.382 -178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ttp85 -96.18 59.49 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.42 -1.326 . . . . 10.0 107.42 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 66.3 -83.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.948 -1.023 . . . . 10.0 112.112 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -93.22 -7.59 44.73 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.282 0.475 . . . . 10.0 112.282 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.0 m -120.84 108.41 13.9 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.738 0.273 . . . . 10.0 111.738 -179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 28.2 m -103.06 120.65 41.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 10.0 110.384 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 44.5 mt -108.01 118.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.735 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -77.19 118.56 19.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.61 124.32 52.06 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.119 0.485 . . . . 10.0 111.221 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -110.71 97.63 7.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.36 -167.82 1.62 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.829 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -126.33 164.21 21.54 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.47 -22.96 62.3 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -85.61 -5.23 59.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 13.5 m -82.24 142.71 31.91 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 38.1 p -90.99 165.38 13.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.779 0.323 . . . . 10.0 110.921 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 76.7 t -65.62 -34.45 70.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.215 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -61.4 -36.09 79.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.455 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -62.69 -38.38 90.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.722 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.38 -42.99 99.6 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.013 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.425 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 99.4 mttt -62.88 -37.46 86.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.62 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -65.82 -34.92 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.041 179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 95.2 mt -66.98 -46.31 85.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.04 -37.13 77.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.746 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.56 -39.98 85.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.671 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.6 -1.54 77.37 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.926 -0.654 . . . . 10.0 113.312 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 82.6 mt -114.41 -53.6 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.887 0.375 . . . . 10.0 111.398 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 60.7 mt -90.38 -6.84 54.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.591 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mptt 60.07 38.81 20.35 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.152 0.501 . . . . 10.0 111.678 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -116.42 133.1 23.02 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.463 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -57.18 133.83 60.12 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 123.073 2.516 . . . . 10.0 112.255 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.5 -22.81 58.43 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.249 2.633 . . . . 10.0 112.614 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -61.5 -37.15 82.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.35 -1.02 57.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.784 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -85.44 135.68 33.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.921 0.391 . . . . 10.0 111.159 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 65.1 mmt-85 -128.0 116.35 19.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.004 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 71.7 mt -98.84 118.44 35.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.034 0.445 . . . . 10.0 111.05 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -115.55 112.44 22.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.491 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -112.78 132.14 55.38 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.68 30.02 19.61 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.107 0.479 . . . . 10.0 110.412 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 68.37 24.19 7.35 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.234 -0.894 . . . . 10.0 111.587 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -130.92 151.47 51.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.127 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.33 130.05 34.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.751 0.31 . . . . 10.0 111.034 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.93 156.58 24.68 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -99.22 121.99 41.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.739 0.304 . . . . 10.0 110.527 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.425 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 8.5 m-20 -58.51 -29.31 66.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.646 -0.706 . . . . 10.0 112.399 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.57 2.53 84.76 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.002 -0.618 . . . . 10.0 112.872 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -106.94 154.27 21.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.986 0.422 . . . . 10.0 111.177 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 22.5 p -88.78 162.56 16.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.165 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 mt -56.98 -36.83 70.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.597 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -34.5 87.14 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.239 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -83.65 -14.12 52.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.049 0.452 . . . . 10.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.8 m -95.34 6.46 48.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.108 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.96 33.3 37.24 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.404 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -94.93 55.09 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.096 0.474 . . . . 10.0 110.618 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.19 148.42 48.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m -60.68 -16.77 42.63 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.77 -26.91 34.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.957 0.408 . . . . 10.0 110.341 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.87 -38.87 12.06 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.21 82.69 2.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.985 -1.007 . . . . 10.0 108.883 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.55 158.21 34.1 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.769 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.69 -15.81 30.18 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.319 2.013 . . . . 10.0 110.696 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -94.29 -16.57 23.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.939 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.41 93.7 1.41 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.119 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -72.99 149.73 47.42 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.928 2.419 . . . . 10.0 112.086 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.58 116.29 10.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.017 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.21 115.78 16.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.147 0.499 . . . . 10.0 111.777 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.09 133.46 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -81.68 130.06 9.45 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.017 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 36.7 tp -109.74 108.42 18.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.982 0.42 . . . . 10.0 111.197 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.74 123.64 46.05 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.652 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -101.11 118.27 36.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -76.29 121.37 22.86 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.09 0.472 . . . . 10.0 111.658 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.87 149.3 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -79.22 133.69 36.68 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.981 -0.288 . . . . 10.0 110.726 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 t70 75.31 -32.84 0.22 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.894 0.701 . . . . 10.0 112.894 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.8 m -69.53 110.9 5.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.961 0.41 . . . . 10.0 110.562 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -84.96 7.35 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.032 0.444 . . . . 10.0 111.61 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.64 -28.04 68.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.26 92.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.97 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -60.57 -30.62 69.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.541 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 44.2 m -70.08 -26.95 64.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.625 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 mt -101.11 2.11 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.832 0.348 . . . . 10.0 111.235 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.49 110.04 44.4 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.202 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -62.27 -16.12 49.06 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 123.055 2.503 . . . . 10.0 111.93 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -79.14 1.63 23.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.605 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 16.6 m -142.72 -45.71 0.31 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.501 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 22.3 m -108.38 133.74 20.47 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.081 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.87 153.63 47.9 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.378 2.052 . . . . 10.0 110.672 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -50.01 120.08 5.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.008 2.472 . . . . 10.0 111.915 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -60.53 121.79 13.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.603 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.1 tp -144.91 122.98 6.54 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 10.0 109.903 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.59 133.78 47.48 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.626 2.217 . . . . 10.0 111.153 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.21 -35.88 78.39 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 23.0 m -69.54 -18.42 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.112 0.482 . . . . 10.0 111.041 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 93.7 mmm -110.2 27.91 9.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.506 0.669 . . . . 10.0 109.35 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -103.22 -49.73 0.15 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.471 -0.786 . . . . 10.0 113.005 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.09 51.09 3.03 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.828 2.352 . . . . 10.0 112.16 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -123.47 177.3 5.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.594 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.03 -174.4 2.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.728 0.299 . . . . 10.0 111.512 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -93.76 158.31 15.73 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.9 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.6 -137.96 8.28 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.938 -0.648 . . . . 10.0 112.751 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -17.87 22.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.856 0.36 . . . . 10.0 111.532 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 74.7 m -148.86 -174.43 4.62 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.062 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.64 151.19 42.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.67 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.2 t30 73.14 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.354 0.872 . . . . 10.0 113.354 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.28 133.72 42.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.044 0.449 . . . . 10.0 111.702 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -117.09 159.1 23.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.639 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.0 106.29 12.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.946 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 t -73.04 123.97 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.128 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.325 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.972 0.415 . . . . 10.0 110.868 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -114.19 106.11 13.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.606 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 64.1 mt -89.89 141.37 28.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.671 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.98 121.55 58.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -95.78 169.69 9.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.946 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -25.19 65.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.038 -0.528 . . . . 10.0 112.424 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -82.18 6.18 17.4 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.667 0.27 . . . . 10.0 111.382 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.99 23.25 76.69 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 10.0 111.638 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -94.67 124.98 39.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -96.53 137.58 35.39 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.266 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -125.69 113.87 17.91 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.257 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -92.94 116.99 35.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.725 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -103.6 134.64 44.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.686 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -66.1 128.42 36.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 19.0 ttt-85 -54.57 -27.6 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.821 0.674 . . . . 10.0 112.821 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -57.2 -41.78 80.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.022 0.439 . . . . 10.0 110.702 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 -85.69 -32.7 21.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.206 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.16 91.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.552 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.46 -44.96 85.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.832 0.349 . . . . 10.0 111.089 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -36.12 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.664 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -66.4 -34.41 77.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.095 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.07 -22.32 75.91 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.31 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -71.47 -28.41 63.92 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.293 0.568 . . . . 10.0 110.216 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 20.9 mt -84.47 141.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -65.38 100.24 0.47 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.931 0.396 . . . . 10.0 110.7 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -101.46 178.01 4.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.491 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 21.6 mmm -78.22 26.33 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 58.5 mt -74.41 -29.93 61.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.151 0.5 . . . . 10.0 110.256 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -90.44 -0.14 57.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.026 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.93 -62.21 5.7 Favored Glycine 0 CA--C 1.52 0.378 0 CA-C-N 115.765 -0.652 . . . . 10.0 113.348 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.36 174.45 3.41 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.666 2.244 . . . . 10.0 112.52 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.98 -62.12 6.01 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.989 -0.624 . . . . 10.0 112.391 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -130.5 125.9 35.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.808 0.337 . . . . 10.0 111.212 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -109.75 75.7 0.96 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.47 165.8 9.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.332 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -53.54 -39.39 64.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.907 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.08 -39.43 92.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.886 0.374 . . . . 10.0 110.516 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.16 -26.27 65.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.637 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -79.06 -17.87 54.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.315 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -90.78 -55.69 3.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.11 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -110.45 96.4 6.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 t -95.1 103.1 14.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.075 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -95.33 122.16 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.085 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -104.21 139.82 38.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.703 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -109.27 138.58 45.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.747 0.308 . . . . 10.0 111.297 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 68.97 8.26 6.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.387 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 85.1 mt -108.54 108.7 61.17 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.277 -0.419 . . . . 10.0 110.501 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.62 149.49 84.02 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.941 2.427 . . . . 10.0 112.046 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 2.6 p -60.28 -38.69 84.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.437 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -55.5 30.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.228 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 21.7 m -66.99 -34.44 69.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.238 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.57 -35.54 81.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.549 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 46.5 m -61.47 -42.55 98.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.551 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -64.52 -36.74 85.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.39 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 96.1 t -64.75 -46.85 90.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.71 -41.63 97.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.994 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 44.1 mtm -65.81 -39.58 91.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.511 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -65.27 -41.36 94.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.036 -0.357 . . . . 10.0 110.036 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.6 -46.99 85.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.901 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 32.8 m -58.16 -46.51 85.57 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.722 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -61.37 -46.81 88.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.63 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -61.62 -38.05 86.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.509 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.58 -44.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.093 0.473 . . . . 10.0 110.417 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.3 mmt85 -78.28 -41.38 34.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.153 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -57.29 -49.03 77.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.919 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.04 15.18 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.915 0.388 . . . . 10.0 111.437 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -119.09 -75.86 0.58 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.628 0.251 . . . . 10.0 111.078 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.66 17.48 5.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 10.0 111.635 -179.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 66.2 m -126.25 32.32 5.24 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.021 0.438 . . . . 10.0 111.246 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.88 3.48 33.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 10.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.69 -23.49 49.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.874 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 47.4 pt -94.87 164.59 19.11 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.608 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -73.48 169.63 21.84 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.394 2.063 . . . . 10.0 111.706 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.62 163.73 10.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.788 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -46.95 131.7 8.82 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.969 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -57.94 113.27 1.45 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.962 2.442 . . . . 10.0 111.656 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 40.0 pt -78.71 45.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.742 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.3 -58.01 0.38 Allowed Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -79.98 108.93 2.3 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.202 1.934 . . . . 10.0 111.169 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.93 62.01 2.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.479 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 4.3 mm -119.15 4.28 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.27 0.557 . . . . 10.0 110.611 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -28.74 52.94 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.15 -0.344 . . . . 10.0 111.128 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 12.6 tp -70.38 -29.8 66.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.476 -0.564 . . . . 10.0 109.476 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -61.99 -33.95 75.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.184 -0.916 . . . . 10.0 109.608 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.63 -32.62 60.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.495 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 52.0 tp -69.45 -17.57 63.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.71 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.5 ttp -64.72 -21.74 66.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.704 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.93 -31.44 72.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.74 -56.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.312 0.856 . . . . 10.0 113.312 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -86.11 56.23 3.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.112 0.482 . . . . 10.0 111.185 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.879 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 112.213 -0.355 . . . . 10.0 112.213 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.42 -53.67 5.82 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 122.483 0.313 . . . . 10.0 111.797 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.7 tp -59.92 -28.64 67.77 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.959 0.409 . . . . 10.0 110.57 -179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -55.87 -28.97 59.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.132 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -107.11 -36.36 6.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.468 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.07 -40.97 91.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.906 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.28 -34.49 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.883 0.373 . . . . 10.0 111.223 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.65 -38.36 90.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.85 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.64 -11.48 59.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.164 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -34.5 14.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.846 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.01 112.31 2.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.098 0.475 . . . . 10.0 111.122 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -81.65 90.91 2.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.8 tttt -101.03 106.96 47.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.273 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -94.7 35.77 0.17 Allowed 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.337 2.691 . . . . 10.0 111.91 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.5 mttm -89.85 175.43 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.113 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -75.42 159.85 30.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.185 0.517 . . . . 10.0 112.022 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.6 mm -115.79 138.23 46.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.917 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -163.96 138.73 4.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -38.91 144.77 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.783 2.989 . . . . 10.0 113.678 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.66 154.01 74.53 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.985 2.457 . . . . 10.0 112.785 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.88 126.29 56.1 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.276 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.23 -19.31 63.22 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.272 2.648 . . . . 10.0 112.703 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -35.99 82.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.754 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -130.18 -128.75 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -156.1 59.76 0.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 10.0 110.441 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.5 tttm -155.66 152.35 28.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.737 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.4 pp -74.0 160.04 31.86 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.674 0.273 . . . . 10.0 110.927 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.31 162.69 12.72 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.104 -178.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.57 111.45 23.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.699 -0.228 . . . . 10.0 110.874 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -164.14 -77.57 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.251 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.97 -53.56 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.691 0.62 . . . . 10.0 110.167 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.817 0 CA-C-O 118.301 -0.856 . . . . 10.0 109.691 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.909 0.385 . . . . 10.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -79.39 131.62 36.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.3 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 90.9 t -118.52 112.99 40.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.184 0.516 . . . . 10.0 110.871 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -100.2 116.49 32.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.797 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -129.53 159.62 35.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 10.0 111.763 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 15.6 mtm -125.57 105.33 8.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.811 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.6 mm -81.15 107.16 13.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -107.39 105.02 14.75 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -92.35 74.86 5.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.803 -1.555 . . . . 10.0 106.803 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 67.29 -82.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.433 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -111.29 -10.54 14.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.796 0.332 . . . . 10.0 111.105 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -92.06 94.95 9.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.565 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.4 m -98.17 112.92 24.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.06 0.457 . . . . 10.0 110.624 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 51.0 mt -107.02 119.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.85 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -78.33 119.41 21.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -112.06 118.34 35.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.3 0.571 . . . . 10.0 111.942 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -103.27 94.81 5.71 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -118.44 -168.57 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.842 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 mmtt -127.17 165.47 19.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -63.36 -22.43 66.87 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.814 0.301 . . . . 10.0 111.814 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 2.7 m -83.1 -8.51 59.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.8 m -77.38 136.77 38.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.077 -0.342 . . . . 10.0 110.077 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 21.1 p -86.14 161.45 18.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.31 -36.53 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.999 0.428 . . . . 10.0 110.337 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -63.99 -30.45 71.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.486 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.69 -35.39 80.62 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.272 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 47.6 mt -60.95 -42.43 98.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.496 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 87.6 mttt -61.96 -36.83 82.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.309 179.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -66.13 -39.16 89.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.949 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -65.73 -48.25 83.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 10.0 109.872 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -63.39 -37.51 79.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.422 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.84 -37.75 80.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.185 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.28 -17.99 79.58 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.938 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.42 -52.15 9.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.983 0.421 . . . . 10.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 34.6 mt -81.44 -17.6 48.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.684 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 63.16 36.47 12.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.802 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -127.87 147.59 63.6 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.76 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.78 130.25 18.77 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.912 3.075 . . . . 10.0 114.134 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.47 -18.37 15.72 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.846 2.364 . . . . 10.0 111.766 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -65.16 -36.04 82.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.13 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -88.12 0.95 55.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.626 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.22 133.06 34.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.901 0.381 . . . . 10.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -123.3 110.04 14.7 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 97.2 mt -91.96 116.2 28.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 10.0 111.534 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -115.19 120.98 41.57 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.02 -0.536 . . . . 10.0 112.027 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 21.0 tttm -121.5 127.26 50.85 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.46 36.98 16.94 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 63.8 20.8 12.39 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.656 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -127.34 146.84 50.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.582 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 tp -79.84 131.67 35.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.341 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 96.6 mt -76.98 156.33 32.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.885 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -95.56 116.51 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.499 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.496 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 50.7 m-20 -59.88 -27.91 67.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.928 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.07 1.5 88.71 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.81 -0.71 . . . . 10.0 113.412 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -113.39 166.3 11.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.583 . . . . 10.0 111.892 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 25.8 p -95.17 171.25 8.85 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.408 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.83 -40.99 97.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.52 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.32 -30.58 71.5 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.397 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.75 -12.35 59.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.771 0.32 . . . . 10.0 111.352 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.3 m -100.69 8.78 43.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.76 0.314 . . . . 10.0 111.556 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.53 1.87 68.22 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.831 -0.7 . . . . 10.0 113.107 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -79.34 106.98 11.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.813 0.339 . . . . 10.0 110.343 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 1.3 p -137.33 174.41 10.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.138 -0.69 . . . . 10.0 109.138 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.11 -3.55 7.76 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.076 0.465 . . . . 10.0 111.537 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -91.18 -42.81 10.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.165 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.49 -34.16 18.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.762 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -106.24 107.45 18.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.483 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 68.9 mtt180 -120.85 158.5 51.98 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.008 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.75 -36.49 82.25 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.132 2.554 . . . . 10.0 113.225 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.84 13.49 24.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 10.0 111.319 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -150.99 75.53 8.21 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.442 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.96 136.75 16.84 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.679 2.252 . . . . 10.0 111.284 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 117.22 8.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.699 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 21.7 m -75.17 126.38 30.91 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.334 0.588 . . . . 10.0 111.63 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 t -122.02 128.19 75.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.164 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.28 126.33 7.36 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -104.92 98.78 8.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.918 0.39 . . . . 10.0 111.121 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.38 116.02 28.57 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -95.97 116.8 29.48 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.691 0.281 . . . . 10.0 110.569 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -74.72 109.22 8.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -130.18 130.64 44.96 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -65.41 136.05 56.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.422 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 20.2 t70 73.1 -7.38 1.51 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.586 -0.734 . . . . 10.0 112.02 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.4 m -95.91 100.38 12.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.094 0.473 . . . . 10.0 109.965 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -72.45 -11.32 60.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.191 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -55.66 -31.67 62.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.358 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.964 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.81 -25.53 59.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.842 0.353 . . . . 10.0 111.185 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -87.67 -30.98 19.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.879 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 54.5 mt -78.61 -33.47 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.17 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.46 115.8 36.35 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-O 120.897 0.38 . . . . 10.0 111.677 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.62 -5.7 16.75 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.471 2.781 . . . . 10.0 112.102 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -68.43 -37.31 80.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.156 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.7 p -108.43 -37.82 5.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.554 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 23.8 m -104.73 141.45 22.57 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.837 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.62 161.78 39.04 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 122.507 2.138 . . . . 10.0 110.719 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.73 135.19 68.28 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.722 2.281 . . . . 10.0 112.398 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -72.79 104.1 3.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 39.4 tp -134.11 121.9 15.9 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.921 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -58.29 127.66 25.63 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.635 2.223 . . . . 10.0 111.665 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.34 -32.83 71.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.362 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.99 -20.23 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.16 0.505 . . . . 10.0 111.192 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 75.3 mmm -113.72 33.16 5.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.846 -0.615 . . . . 10.0 109.638 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -97.25 -54.86 0.2 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 113.092 0.775 . . . . 10.0 113.092 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.09 77.29 2.81 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.554 2.169 . . . . 10.0 112.483 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -139.74 172.37 12.88 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.612 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -89.39 167.38 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.0 m -100.59 135.76 41.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.87 0.367 . . . . 10.0 110.311 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.27 -153.71 12.68 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.792 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.4 p -93.49 -28.71 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 10.0 111.039 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 m -86.04 157.04 20.17 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.616 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.17 122.76 17.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.374 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 72.64 16.7 4.7 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 123.721 0.638 . . . . 10.0 111.791 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -81.88 126.92 32.47 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -105.54 138.9 40.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.462 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.41 106.81 14.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.15 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -74.34 123.5 29.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.725 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.155 179.554 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.236 0.354 0 CA-C-O 120.847 0.356 . . . . 10.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 66.8 tttt -108.43 122.29 46.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 10.0 111.004 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 59.3 mt -99.2 124.99 44.68 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 2.9 mt -108.11 126.52 64.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.3 p -99.46 167.42 10.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.55 -0.295 . . . . 10.0 110.459 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.2 m -66.92 -12.75 60.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 10.0 111.595 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.22 -5.44 59.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.115 0.483 . . . . 10.0 110.266 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.69 16.2 66.42 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.837 -0.697 . . . . 10.0 111.936 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.39 133.22 33.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 10.0 110.573 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -100.52 120.82 40.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.761 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -112.78 114.32 26.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.614 0.245 . . . . 10.0 110.888 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 25.9 mm -98.2 119.97 46.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 16.8 t -106.28 136.99 38.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.793 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 55.5 tttt -60.85 128.92 38.87 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.351 -0.386 . . . . 10.0 109.98 179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -52.43 -32.89 41.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.394 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.629 . . . . 10.0 111.137 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -81.54 -31.11 32.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.154 0.502 . . . . 10.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.14 92.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.737 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 61.7 mt -59.7 -48.99 79.47 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.759 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.79 -42.6 99.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.985 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -62.85 -39.1 93.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.547 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.68 -13.56 82.02 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.525 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 33.1 m -75.36 -26.88 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.218 0.533 . . . . 10.0 110.283 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 18.0 mt -83.49 153.32 3.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -64.67 93.24 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.936 0.398 . . . . 10.0 110.429 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -99.58 -178.75 3.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.377 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 67.6 mmm -77.58 28.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.641 0.608 . . . . 10.0 112.641 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.85 -28.41 65.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.094 0.473 . . . . 10.0 110.434 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 m -90.39 3.75 52.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.475 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.61 -64.24 3.43 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.695 -0.684 . . . . 10.0 113.461 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.22 175.19 4.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.6 2.2 . . . . 10.0 112.362 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.24 -33.58 64.68 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.293 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -154.47 136.28 14.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.414 . . . . 10.0 110.861 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -118.45 72.48 0.87 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.43 172.71 8.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.365 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -53.17 -31.19 41.4 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.23 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -62.9 -39.67 95.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.038 0.447 . . . . 10.0 110.378 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.54 -29.12 56.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.608 -0.723 . . . . 10.0 110.62 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -73.3 -27.7 61.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.032 0.444 . . . . 10.0 110.562 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -79.14 -57.81 3.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.755 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -128.61 109.53 11.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.135 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.6 t -94.2 109.78 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.179 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -90.33 110.85 21.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.914 0.387 . . . . 10.0 110.949 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -90.14 125.45 35.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -99.14 136.6 38.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.344 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 64.33 25.15 13.42 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.686 0.617 . . . . 10.0 111.278 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 79.1 mt -124.66 103.91 31.16 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.514 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.04 154.98 58.45 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.289 2.659 . . . . 10.0 112.346 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 13.2 p -65.02 -35.76 82.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -55.4 -57.06 13.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 10.0 112.226 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.8 m -66.71 -35.76 75.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.388 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 21.4 tp -64.5 -38.95 92.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.742 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 58.9 m -60.74 -41.54 95.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.38 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -64.49 -38.33 90.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.624 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.03 -44.76 91.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.074 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.3 m -60.73 -44.33 96.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.803 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.5 mtm -66.62 -36.79 83.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.569 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -64.7 -41.91 95.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.041 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.19 -44.72 95.96 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.79 -0.448 . . . . 10.0 109.79 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 24.2 m -60.09 -41.41 92.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.749 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -63.45 -44.69 93.77 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.555 -0.748 . . . . 10.0 109.806 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -63.26 -40.14 96.58 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.371 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.87 -48.28 88.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.275 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 mmt85 -72.67 -38.7 67.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.378 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -57.68 -53.72 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.959 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.2 43.21 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.496 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -155.39 -54.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.174 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.91 -40.12 0.95 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.033 0.444 . . . . 10.0 111.506 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -83.31 53.35 2.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.011 0.434 . . . . 10.0 111.455 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.38 -1.12 45.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.266 0.555 . . . . 10.0 110.342 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.55 -22.56 22.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.056 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 36.5 pt -90.94 160.98 36.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.03 176.95 9.49 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.156 1.904 . . . . 10.0 112.819 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -67.12 170.22 7.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.975 -1.011 . . . . 10.0 109.74 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -50.24 130.91 24.52 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.475 -0.329 . . . . 10.0 111.084 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.23 125.11 17.78 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.928 2.419 . . . . 10.0 112.621 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 17.5 pt -80.57 52.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -109.51 -56.34 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.475 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.13 106.15 1.31 Allowed 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.968 1.779 . . . . 10.0 112.046 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.46 59.35 0.6 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.105 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 10.6 mm -120.48 -7.31 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.573 . . . . 10.0 110.639 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.77 -35.42 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.741 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 23.9 tp -67.82 -36.15 79.87 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.5 -35.75 81.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.116 -0.947 . . . . 10.0 109.64 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.56 -35.62 65.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.209 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.33 -23.56 67.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.725 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.6 ttp -60.47 -22.04 63.04 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.107 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.52 -34.56 77.13 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.449 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.17 -65.31 0.19 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 124.096 0.873 . . . . 10.0 113.131 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -82.46 55.67 3.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.413 0.625 . . . . 10.0 110.622 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--O 1.246 0.919 0 CA-C-N 115.163 -0.926 . . . . 10.0 108.75 179.606 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.428 -0.269 . . . . 10.0 112.428 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -63.14 1.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -179.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.2 tp -61.02 -27.94 68.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.329 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -52.6 -34.1 49.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.105 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -106.47 -35.0 7.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.885 0.374 . . . . 10.0 110.648 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 61.6 mt -59.34 -45.9 90.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.921 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.673 0.273 . . . . 10.0 111.03 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.5 tp -64.22 -37.51 87.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.272 0.558 . . . . 10.0 110.082 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.51 -15.02 53.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.638 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.82 -32.71 31.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.32 114.98 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.618 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.0 pt -81.01 94.18 2.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.363 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -108.8 95.26 16.37 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.657 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -84.39 78.99 2.66 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.105 2.537 . . . . 10.0 110.936 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -130.05 -170.49 2.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.387 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 49.1 mm-40 -94.16 164.71 12.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.669 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.3 mm -114.56 159.23 14.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.058 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 179.92 142.0 0.34 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -40.68 135.47 2.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.243 2.629 . . . . 10.0 112.044 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.52 137.15 58.21 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.827 2.351 . . . . 10.0 112.388 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.01 118.33 34.62 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.069 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.62 -22.18 73.84 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.053 2.502 . . . . 10.0 112.617 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.03 -14.55 59.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.046 -0.524 . . . . 10.0 111.2 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.1 -138.63 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.282 -179.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -154.66 49.23 0.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 10.0 110.085 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -149.55 147.93 28.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.445 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.28 159.38 32.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.718 0.294 . . . . 10.0 111.158 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.72 169.04 9.53 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.429 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -115.86 120.17 38.36 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.298 -0.26 . . . . 10.0 110.298 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -162.55 -65.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.127 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.07 -57.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.957 -1.127 . . . . 10.0 107.957 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 114.695 -1.139 . . . . 10.0 109.191 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tmm? . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.692 0.282 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.03 134.52 45.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.373 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.43 120.19 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 121.208 0.528 . . . . 10.0 111.707 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -109.84 114.71 28.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.199 179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 160.95 32.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.843 0.354 . . . . 10.0 111.56 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 46.6 mtm -129.61 107.2 9.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.011 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -81.91 102.4 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -101.18 103.41 14.45 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.3 ttp85 -88.66 71.26 8.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 177.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 68.02 -81.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.193 -0.912 . . . . 10.0 111.098 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -107.28 -16.32 14.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.903 0.382 . . . . 10.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.09 97.69 10.11 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.102 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 4.3 m -97.24 115.66 28.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.886 0.374 . . . . 10.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.92 118.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.105 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -77.93 120.8 23.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -114.05 121.97 45.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.091 0.472 . . . . 10.0 111.976 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -107.96 98.25 7.85 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.06 -1.089 . . . . 10.0 108.06 178.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.77 -167.75 1.63 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.324 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -126.22 160.61 29.81 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -60.81 -20.62 61.96 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 12.7 m -86.73 -7.91 57.86 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m -78.11 142.59 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 31.6 p -90.19 164.06 14.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.787 0.327 . . . . 10.0 110.794 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 75.4 t -63.26 -39.31 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.369 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -61.59 -32.27 72.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.22 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.96 -38.81 89.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.633 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -60.68 -42.42 97.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.033 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.421 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 94.9 mttt -64.84 -35.41 81.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.967 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -66.79 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 77.7 mt -73.18 -46.3 51.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.52 -34.72 62.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.521 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.07 -37.38 71.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.864 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.22 -5.71 89.87 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.905 -0.664 . . . . 10.0 113.072 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -105.15 -49.09 9.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.985 0.421 . . . . 10.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.32 -8.54 54.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.412 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 79.0 mttt 56.92 46.48 19.5 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.377 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -142.64 143.09 24.8 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.576 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.84 133.56 45.69 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.438 2.758 . . . . 10.0 113.488 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.94 -16.08 32.63 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.033 2.489 . . . . 10.0 111.957 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.54 -29.05 70.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.434 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -96.09 3.12 53.56 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.946 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.98 132.74 35.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 111.207 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 73.0 mmt-85 -123.86 115.89 22.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.073 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 83.4 mt -93.41 123.09 36.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.163 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -117.26 119.47 35.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.519 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -125.1 134.19 52.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 57.74 34.71 24.78 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.296 0.372 . . . . 10.0 110.623 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 65.97 16.14 10.35 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.682 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -123.89 159.76 28.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.825 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.1 tp -87.89 134.32 33.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 85.8 mt -80.71 152.2 28.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.14 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -92.96 118.47 31.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.143 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.421 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 16.3 m-20 -60.25 -26.96 66.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.66 3.74 85.03 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.738 -0.744 . . . . 10.0 113.118 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -108.23 164.99 11.83 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.152 0.501 . . . . 10.0 111.574 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.2 p -96.34 169.71 9.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.675 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 32.1 mt -62.37 -39.08 92.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.543 -0.298 . . . . 10.0 111.146 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.15 -39.28 94.27 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.031 -0.604 . . . . 10.0 112.594 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -75.02 -24.28 58.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 10.0 110.958 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 63.9 m -85.86 4.44 37.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.766 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.37 14.64 61.61 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.668 -0.777 . . . . 10.0 113.413 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -87.4 67.23 9.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.968 0.413 . . . . 10.0 110.14 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -95.01 161.89 13.95 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 24.8 m -65.83 -7.63 17.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 10.0 111.56 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -74.71 -48.54 25.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.313 0.578 . . . . 10.0 109.578 178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.03 -40.5 18.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.453 -0.794 . . . . 10.0 109.971 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -95.46 100.41 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.55 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -115.39 159.42 38.37 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.707 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -58.38 -19.26 42.55 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.881 2.388 . . . . 10.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.41 8.25 14.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.061 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -153.14 84.51 4.41 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.597 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -78.31 137.47 15.05 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.844 2.362 . . . . 10.0 111.33 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.12 115.97 9.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.3 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.18 123.32 21.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.441 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 21.6 t -122.41 135.58 62.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.49 135.14 12.95 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.684 -0.77 . . . . 10.0 111.695 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.3 tp -116.81 99.92 7.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.96 0.41 . . . . 10.0 111.552 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.87 125.28 37.4 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -106.46 125.36 50.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.699 0.285 . . . . 10.0 110.96 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -75.31 112.18 11.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.061 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.36 139.82 48.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.34 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -77.98 145.1 36.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.392 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 61.14 15.85 6.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.041 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.5 m -127.7 107.99 10.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.638 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -87.25 4.99 40.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.613 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.9 -28.71 67.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.419 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.57 68.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.02 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.3 mt -71.36 -28.0 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.895 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 19.1 m -80.99 -25.82 36.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.245 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 mt -91.36 -9.83 10.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.024 0.44 . . . . 10.0 110.817 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -91.45 107.52 22.35 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.641 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -68.59 -11.85 33.06 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 10.0 111.582 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -71.23 -38.22 71.98 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.211 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -100.74 -45.75 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.205 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -106.53 155.35 38.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.771 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 160.81 30.82 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.507 2.138 . . . . 10.0 111.632 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.83 139.85 70.59 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.413 2.075 . . . . 10.0 111.923 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -70.98 96.33 1.29 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.216 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 34.0 tp -130.46 122.84 20.07 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.95 179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -66.01 141.24 63.38 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.902 2.402 . . . . 10.0 111.896 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.79 -35.05 79.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.53 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.31 -23.38 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.154 0.502 . . . . 10.0 111.012 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.2 mmm -113.88 59.19 0.67 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.424 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 34.1 ttpt -138.33 -50.88 0.02 OUTLIER Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.565 -0.743 . . . . 10.0 112.269 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . 0.424 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 12.5 Cg_exo -73.65 50.6 2.07 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.877 2.385 . . . . 10.0 112.199 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -124.02 160.01 28.6 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.851 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.91 175.5 9.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.894 0.378 . . . . 10.0 111.497 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.9 m -99.82 137.69 37.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.511 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.75 -133.44 2.33 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.432 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.57 -43.3 5.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.037 0.446 . . . . 10.0 111.285 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 15.0 m -81.57 161.23 23.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.271 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 135.59 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.58 0.13 3.55 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.668 0.605 . . . . 10.0 111.391 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.39 115.83 19.26 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.936 0.398 . . . . 10.0 110.421 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -96.98 138.47 34.46 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.069 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.31 108.29 16.73 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.959 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.3 126.57 39.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.372 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.053 179.507 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.966 0.412 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -106.39 117.8 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.051 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.44 123.96 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 20.6 mt -111.51 118.57 57.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -93.38 166.59 12.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.439 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -9.79 29.75 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -87.91 4.25 45.49 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.863 0.363 . . . . 10.0 110.652 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.91 23.89 73.49 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.563 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -96.98 128.23 43.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 10.0 110.659 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -101.08 118.39 36.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.387 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -109.8 117.27 33.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.767 0.317 . . . . 10.0 111.048 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.4 mm -100.22 113.42 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.72 136.54 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.47 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -59.59 128.61 37.86 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.27 -0.641 . . . . 10.0 109.27 178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -56.38 -28.34 58.92 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -57.19 -51.97 67.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 10.0 110.196 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -73.63 -29.61 62.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.097 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -33.48 76.11 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.073 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.84 -47.46 84.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.231 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 1.1 m -66.01 -36.34 83.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.833 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 23.3 m -68.26 -17.93 64.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.441 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -86.55 -16.17 62.5 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.063 -0.815 . . . . 10.0 111.063 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.9 m -83.55 -28.55 28.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.351 0.596 . . . . 10.0 109.639 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.11 141.96 15.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -70.38 88.46 0.65 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.356 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -99.06 177.05 5.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.396 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 89.2 mmm -80.07 36.97 0.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.74 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 tp -68.15 -30.33 69.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.415 0.626 . . . . 10.0 109.368 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.63 15.93 10.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.286 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.91 -64.03 3.36 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.525 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.65 169.5 12.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.565 2.176 . . . . 10.0 111.926 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.96 -52.73 50.48 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.116 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -139.08 116.62 11.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.825 0.345 . . . . 10.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -84.84 93.22 8.45 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.18 165.91 23.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.986 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -59.98 -25.35 65.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.313 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.17 -37.9 88.84 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -74.27 -30.54 62.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.046 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.69 -22.35 58.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.322 0.582 . . . . 10.0 109.74 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -83.63 -61.88 1.72 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.148 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -130.8 109.33 10.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.512 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -90.7 119.98 38.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.856 -179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -93.61 114.41 26.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.9 0.381 . . . . 10.0 110.689 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -103.95 99.09 8.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.359 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -89.12 147.0 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.053 -0.522 . . . . 10.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 69.75 17.91 7.59 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.698 0.624 . . . . 10.0 111.21 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.3 mt -124.73 109.52 28.14 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.895 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.91 144.52 99.45 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.048 2.499 . . . . 10.0 112.02 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.4 p -62.12 -36.76 82.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.19 -55.35 32.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.811 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.7 m -66.27 -36.26 76.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.865 -0.334 . . . . 10.0 111.214 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -63.89 -36.45 83.96 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.329 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -62.37 -41.7 98.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.058 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -66.11 -37.64 86.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.171 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.59 -44.72 98.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 61.5 m -61.25 -42.7 99.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.433 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.4 mtm -65.15 -37.78 88.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.474 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -65.15 -43.76 90.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.403 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -61.48 -44.03 97.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.003 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 27.0 m -58.77 -43.31 90.37 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.943 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -65.13 -43.77 90.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.145 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -62.57 -40.4 96.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.293 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 44.0 t -58.82 -50.89 77.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.447 . . . . 10.0 109.911 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -69.8 -38.78 76.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.353 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -57.87 -46.35 84.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 10.0 110.822 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.62 18.72 3.78 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.343 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -125.62 -49.5 1.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.868 0.366 . . . . 10.0 111.553 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.72 -31.24 0.39 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.982 0.42 . . . . 10.0 111.774 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 6.7 m -81.44 31.7 0.34 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.403 0.519 . . . . 10.0 112.403 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.45 -12.63 60.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.339 0.59 . . . . 10.0 110.215 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -77.16 -30.32 54.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.37 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 36.7 pt -84.25 165.0 40.98 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -70.95 167.58 25.57 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.403 2.069 . . . . 10.0 112.872 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -66.4 165.19 14.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.209 -0.905 . . . . 10.0 109.607 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -46.16 126.41 7.3 Favored Pre-proline 0 C--O 1.233 0.223 0 O-C-N 123.56 0.538 . . . . 10.0 111.32 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -51.21 119.72 5.81 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.097 2.532 . . . . 10.0 112.598 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 12.8 pt -79.58 47.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.729 -0.668 . . . . 10.0 110.872 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -96.49 -55.87 0.2 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -71.15 107.78 2.19 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.032 1.822 . . . . 10.0 111.88 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.79 59.87 1.64 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.741 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.3 mm -120.78 -2.66 8.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.268 0.556 . . . . 10.0 110.462 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.7 -34.02 76.06 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.149 -0.344 . . . . 10.0 111.862 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 28.4 tp -66.11 -35.56 80.82 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.279 0.561 . . . . 10.0 109.797 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -63.17 -34.4 77.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.254 -0.885 . . . . 10.0 109.717 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 82.0 mt -73.82 -31.87 63.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.925 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 97.1 mt -67.24 -17.05 64.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.055 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.6 ttp -69.46 -13.96 62.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.18 -33.32 74.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.932 -0.396 . . . . 10.0 109.932 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.84 -67.84 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.288 0.847 . . . . 10.0 113.288 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -83.89 42.5 0.86 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 10.0 111.437 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.246 0.873 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 179.583 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -60.03 4.32 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.4 tp -62.91 -29.03 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 10.0 112.012 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -58.96 -33.37 70.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 10.0 111.125 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -95.93 -37.79 10.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.454 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.69 -45.9 87.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.425 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.07 -28.25 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 10.0 111.308 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.88 -33.09 75.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 10.0 110.373 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.91 -13.03 40.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.243 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.98 -35.49 23.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.708 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 tp -159.62 122.44 3.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.371 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.1 mt -89.31 88.11 2.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -99.18 102.86 17.12 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.179 0.437 . . . . 10.0 112.179 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -89.48 93.1 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.162 2.575 . . . . 10.0 110.261 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -157.2 177.49 11.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.462 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 45.3 mm-40 -87.36 152.38 22.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.96 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.2 mm -118.13 107.14 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.27 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.9 tttp -117.68 144.32 34.09 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -32.3 133.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 124.265 3.31 . . . . 10.0 113.742 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.2 138.15 70.4 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 123.105 2.537 . . . . 10.0 112.701 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.76 124.79 91.16 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.404 179.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.63 -10.36 28.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.218 2.612 . . . . 10.0 112.912 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -36.84 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.861 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.24 -103.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.399 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -178.33 63.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.899 0.48 . . . . 10.0 111.112 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -156.09 145.03 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 pp -72.05 149.5 44.81 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.12 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 m -84.67 137.7 33.1 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -97.28 80.85 2.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.108 0.48 . . . . 10.0 110.564 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -125.87 -75.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.601 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.85 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.468 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.666 -0.683 . . . . 10.0 109.396 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 mmm . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.666 0.27 . . . . 10.0 111.177 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.82 131.02 3.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.144 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t -134.93 121.8 35.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.962 0.41 . . . . 10.0 111.004 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -111.26 121.01 44.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.719 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.6 160.19 39.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.811 0.339 . . . . 10.0 111.366 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 37.3 mtm -126.45 108.42 11.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.043 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -80.44 103.6 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -98.97 102.64 14.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -90.46 69.59 6.88 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.228 -1.397 . . . . 10.0 107.228 177.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 68.57 -77.05 0.05 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.888 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -112.06 -20.9 11.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.892 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -90.5 101.0 13.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.773 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 3.0 m -100.48 117.19 34.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.949 0.404 . . . . 10.0 110.812 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -107.27 116.75 51.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.02 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -76.82 118.32 19.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.4 m -110.31 117.92 34.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.122 0.487 . . . . 10.0 111.529 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -108.73 103.73 12.88 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.131 -1.063 . . . . 10.0 108.131 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -135.05 -159.66 0.98 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.902 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -129.73 167.91 17.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 -64.81 -23.55 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.909 0.385 . . . . 10.0 110.793 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -16.76 63.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.547 -0.751 . . . . 10.0 111.798 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.7 m -78.46 145.54 34.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.746 0.308 . . . . 10.0 110.725 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 16.7 p -98.39 163.81 12.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.311 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.6 -38.09 77.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 110.491 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -61.18 -31.8 71.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.515 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -72.38 -28.12 62.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.772 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.6 mt -65.9 -41.4 91.54 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.556 ' HZ2' ' CG ' ' B' ' 53' ' ' ASP . 91.2 mttt -60.46 -36.65 78.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.95 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -63.71 -41.01 98.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.144 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -65.77 -47.04 87.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.022 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.32 -40.6 89.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.209 0.528 . . . . 10.0 110.234 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.58 -38.71 92.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.875 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.86 -15.01 66.34 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.735 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.4 mt -103.69 -50.07 9.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 10.0 111.48 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 65.9 mt -83.51 -20.94 33.01 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.635 0.605 . . . . 10.0 112.635 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt 57.77 53.49 7.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.213 0.53 . . . . 10.0 111.61 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 73.4 mtt-85 -139.9 154.51 70.72 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.636 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.48 121.72 6.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.55 2.834 . . . . 10.0 113.766 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.28 -18.44 20.68 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.868 2.379 . . . . 10.0 112.645 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -70.49 -25.01 62.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.826 0.346 . . . . 10.0 111.846 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -95.68 3.31 54.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -84.06 102.53 12.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.783 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 64.1 mmt-85 -89.65 97.86 11.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.135 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 87.5 mt -82.11 111.29 18.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.31 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -110.25 115.62 30.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -124.39 137.22 54.48 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.231 -1.026 . . . . 10.0 108.231 178.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 61.71 26.4 16.06 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.253 0.346 . . . . 10.0 110.329 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 72.66 12.47 5.39 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.159 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -127.05 162.27 26.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.382 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.7 tp -82.35 133.64 35.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.587 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 74.5 mt -77.94 146.76 35.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.73 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -94.49 122.26 36.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 10.0 111.592 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.556 ' CG ' ' HZ2' ' B' ' 28' ' ' LYS . 9.1 m-20 -60.88 -26.79 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.218 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.47 11.98 59.98 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.508 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mttp -126.12 153.86 43.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.005 0.431 . . . . 10.0 111.19 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 34.8 p -84.45 170.09 13.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.807 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.08 -39.39 89.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.4 -0.363 . . . . 10.0 111.072 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.21 96.21 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.64 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -69.94 -19.14 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.858 0.361 . . . . 10.0 111.332 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.28 10.26 22.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.933 0.397 . . . . 10.0 111.475 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.82 51.49 5.87 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.654 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -114.99 78.62 1.18 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.925 0.393 . . . . 10.0 110.486 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -92.21 168.09 11.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -11.41 57.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.14 0.495 . . . . 10.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -83.71 -40.63 18.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.124 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.1 -27.83 26.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.479 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.25 94.85 4.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.573 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -116.04 155.37 48.08 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.769 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.6 -13.39 35.01 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.162 1.908 . . . . 10.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -4.96 22.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.948 -1.024 . . . . 10.0 110.056 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -164.3 93.07 1.01 Allowed Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.965 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -78.14 140.43 17.74 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.8 2.333 . . . . 10.0 110.914 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.61 113.52 4.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.43 122.97 20.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.813 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 53.9 t -120.23 132.61 69.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 108.655 -0.868 . . . . 10.0 108.655 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.86 131.25 10.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.244 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 46.4 tp -109.26 97.05 6.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.964 0.411 . . . . 10.0 111.04 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.78 105.55 17.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.136 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -88.89 105.63 17.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.133 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -77.41 116.93 18.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.318 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -125.06 148.58 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.207 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.85 130.1 42.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.383 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t0 61.9 27.76 16.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.534 0.683 . . . . 10.0 111.382 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 13.6 m -124.16 106.05 10.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.241 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -78.52 -9.63 59.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.859 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.28 -38.42 71.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.948 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.62 74.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.916 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.14 -24.57 65.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.471 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 13.9 m -84.17 -21.19 31.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.913 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 34.5 mt -91.91 -34.45 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.108 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -64.24 115.49 20.04 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.58 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -66.87 -11.06 30.61 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.037 2.491 . . . . 10.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -72.8 -25.86 61.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.765 -0.458 . . . . 10.0 109.765 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.63 -51.4 2.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.597 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 41.9 m -96.55 139.51 21.69 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.396 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.76 166.38 29.03 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.673 2.249 . . . . 10.0 111.181 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.45 115.19 2.3 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.729 2.286 . . . . 10.0 112.281 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -70.31 99.76 1.6 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.931 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 tp -131.83 128.28 21.56 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.336 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.06 124.91 15.82 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.034 2.49 . . . . 10.0 112.151 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.58 -38.79 85.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.459 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 m -67.14 -19.0 24.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.188 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 66.8 mmm -115.71 41.01 2.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -111.65 -53.13 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -73.96 66.5 5.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.587 2.191 . . . . 10.0 112.237 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -134.37 173.98 11.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.711 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . 0.428 ' CB ' HE22 ' B' ' 118' ' ' GLN . 2.2 t70 -87.18 179.84 6.57 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 9.5 m -108.79 148.33 30.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.262 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.75 -150.16 18.82 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.26 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.6 -31.59 15.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.293 0.568 . . . . 10.0 110.458 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.3 m -96.09 163.78 12.97 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.092 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.18 140.55 54.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.18 -8.14 1.04 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.623 0.577 . . . . 10.0 111.73 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.56 125.89 29.93 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -110.27 156.15 21.08 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.977 0.417 . . . . 10.0 111.143 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -123.15 103.3 8.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.045 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.25 126.79 34.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.577 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . 0.428 HE22 ' CB ' ' B' ' 107' ' ' ASP . 15.2 mp0 . . . . . 0 C--O 1.237 0.43 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.193 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.049 0.452 . . . . 10.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -109.71 122.58 47.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.575 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 41.1 mt -99.28 132.26 44.73 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.916 179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 11.2 mt -114.51 119.64 62.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.721 0.296 . . . . 10.0 110.22 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 m -85.55 156.52 20.72 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.319 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.7 m -61.82 -25.13 67.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -9.22 58.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.845 0.355 . . . . 10.0 111.263 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.83 28.87 8.02 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.686 -0.768 . . . . 10.0 112.895 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 8.7 m170 -101.61 145.76 28.62 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.785 -0.244 . . . . 10.0 110.346 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -114.74 130.76 56.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.358 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -122.91 118.85 28.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.496 -0.32 . . . . 10.0 110.801 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.4 mm -102.04 118.58 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 25.3 t -106.84 139.89 26.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 121.229 -0.188 . . . . 10.0 110.77 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -60.26 128.5 37.07 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -54.3 -32.85 57.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.983 0.364 . . . . 10.0 111.983 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.34 -37.98 76.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.016 0.436 . . . . 10.0 110.937 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -86.08 -40.17 16.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.178 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.35 90.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.987 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 72.7 mt -59.65 -46.2 89.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.934 0.397 . . . . 10.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -67.81 -32.35 72.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.527 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 25.7 m -69.12 -34.78 75.59 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.1 -10.5 84.18 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.657 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 7.9 m -81.13 -21.49 39.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.92 -0.771 . . . . 10.0 108.92 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -81.28 154.69 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.247 -1.02 . . . . 10.0 108.247 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -73.53 82.59 1.49 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.992 0.425 . . . . 10.0 110.732 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.52 170.06 10.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.955 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 82.6 mmm -78.89 45.13 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.527 0.565 . . . . 10.0 112.527 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.87 -26.47 62.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.273 0.559 . . . . 10.0 109.554 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.76 6.05 37.01 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.346 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.03 -58.44 14.52 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.432 -0.804 . . . . 10.0 113.338 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.47 -175.48 1.58 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.264 1.976 . . . . 10.0 111.899 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.62 -58.71 5.68 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.69 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -137.23 118.32 14.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.69 0.281 . . . . 10.0 110.282 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -79.79 83.18 5.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.148 0.499 . . . . 10.0 110.049 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.94 158.57 34.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.197 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.9 -27.67 60.98 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.752 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -60.37 -45.24 94.22 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -74.29 -28.91 61.41 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.523 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -67.48 -26.25 66.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 10.0 110.789 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -89.98 -57.63 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -119.44 93.22 4.0 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.791 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.3 t -80.54 108.53 14.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.125 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -92.57 118.25 30.81 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.761 0.315 . . . . 10.0 110.246 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -95.33 138.99 32.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 mmt85 -105.48 135.37 47.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.123 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 62.04 27.46 16.6 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.722 0.638 . . . . 10.0 111.796 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 81.6 mt -124.56 107.06 29.53 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-O 121.072 0.463 . . . . 10.0 111.02 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -70.84 138.38 34.26 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.204 2.603 . . . . 10.0 111.913 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.97 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -34.17 71.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.06 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.4 m -93.59 -27.89 4.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.676 -0.41 . . . . 10.0 110.586 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -67.39 -34.0 76.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.951 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.93 -40.27 92.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.052 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -65.49 -35.38 80.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.403 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.16 -42.98 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 47.1 m -62.86 -41.48 99.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.352 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 60.9 mtm -66.49 -37.14 84.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.614 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -64.02 -44.1 93.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.165 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -61.88 -44.24 97.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.281 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 30.1 m -60.62 -42.54 97.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.836 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -65.19 -42.04 93.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.997 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . 0.452 ' HZ3' ' CD ' ' C' ' 74' ' ' GLU . 20.9 tptt -62.79 -42.62 99.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.523 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 68.3 t -60.03 -46.21 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.605 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -72.4 -38.47 68.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.958 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -59.8 -55.34 35.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.134 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 51.94 1.83 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.989 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -170.14 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.309 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.77 -38.27 1.01 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.326 0.491 . . . . 10.0 112.326 -178.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 2.3 m -83.75 28.44 0.58 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.919 0.39 . . . . 10.0 111.78 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.48 -12.96 61.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.844 0.354 . . . . 10.0 111.0 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -82.74 -20.42 36.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.73 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 40.1 pt -99.42 169.08 8.6 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.758 -0.201 . . . . 10.0 110.463 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.98 173.32 14.17 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.272 1.982 . . . . 10.0 113.002 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . 0.452 ' CD ' ' HZ3' ' C' ' 62' ' ' LYS . 15.4 tp10 -70.12 177.69 3.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.692 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -53.94 127.35 53.46 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -54.4 120.26 7.73 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.76 2.307 . . . . 10.0 112.315 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 12.5 pt -76.16 55.93 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.396 0.617 . . . . 10.0 110.917 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -102.28 -56.69 0.11 Allowed Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.834 -0.621 . . . . 10.0 112.187 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . 0.406 ' C ' ' H ' ' C' ' 81' ' ' ILE . 16.9 Cg_exo -68.19 121.01 7.97 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.691 1.594 . . . . 10.0 110.529 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -77.62 29.02 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . 0.406 ' H ' ' C ' ' C' ' 79' ' ' PRO . 46.9 mm -116.71 96.71 4.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.121 -0.696 . . . . 10.0 109.121 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.14 -40.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.431 -0.804 . . . . 10.0 109.605 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 tp -67.56 -22.77 65.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.617 -0.882 . . . . 10.0 108.617 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 mp0 -64.83 -32.76 74.6 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.812 -1.085 . . . . 10.0 109.164 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 64.9 mt -80.44 -33.55 36.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.297 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.104 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 36.2 ttp -63.61 -16.79 61.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.129 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.28 69.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.093 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.51 -68.65 0.17 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.053 0.76 . . . . 10.0 113.053 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -82.04 45.8 0.95 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 10.0 111.342 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.244 0.809 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 179.614 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 120.719 0.066 . . . . 10.0 112.962 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -68.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.324 0.861 . . . . 10.0 113.324 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.6 -29.14 69.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.351 -178.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.54 -31.41 46.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.116 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -105.07 -42.9 5.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.383 179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -57.88 -41.44 82.51 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.26 70.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.729 0.3 . . . . 10.0 111.788 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 tp -67.75 -31.01 70.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 10.0 111.379 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.3 11.02 7.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.173 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.51 -52.6 1.6 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.011 0.434 . . . . 10.0 110.572 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.3 mt -131.56 94.36 3.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.341 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.9 mt -73.76 100.83 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.885 0.374 . . . . 10.0 110.544 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -103.69 101.8 26.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.59 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -90.3 58.75 1.57 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.988 2.458 . . . . 10.0 111.91 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -110.02 -170.53 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.54 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -87.51 163.45 16.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.1 mm -112.61 144.84 19.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.669 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.33 138.85 0.97 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.006 -0.738 . . . . 10.0 109.006 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -42.74 140.13 3.0 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.198 2.598 . . . . 10.0 112.423 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.14 134.52 34.23 Favored 'Trans proline' 0 N--CA 1.465 -0.147 0 C-N-CA 122.846 2.364 . . . . 10.0 112.229 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.97 119.24 76.32 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.367 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.27 -15.28 33.96 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.286 2.657 . . . . 10.0 113.305 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -32.41 73.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.251 0.548 . . . . 10.0 109.638 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.42 -127.24 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.434 -0.803 . . . . 10.0 108.861 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -163.45 61.21 0.17 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.446 0.641 . . . . 10.0 110.223 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.1 tttm -157.03 150.69 24.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.086 -0.961 . . . . 10.0 108.815 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 pp -73.9 150.56 40.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.782 0.325 . . . . 10.0 110.751 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.5 m -88.06 169.51 11.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.824 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -116.77 121.97 43.1 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.975 -0.379 . . . . 10.0 109.975 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -166.9 -75.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.252 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.413 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 170.96 -47.48 0.01 OUTLIER 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.322 -179.803 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.1 tmm? . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.866 0.365 . . . . 10.0 110.526 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.67 138.71 50.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.141 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.0 t -131.04 120.17 46.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.152 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -109.48 120.71 43.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.472 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.69 159.33 38.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.8 0.333 . . . . 10.0 111.341 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 46.6 mtm -128.74 109.54 11.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.77 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 38.7 mm -82.05 105.19 11.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -104.87 104.58 14.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.07 0.767 . . . . 10.0 113.07 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.3 ttp85 -93.68 81.34 4.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.215 -1.402 . . . . 10.0 107.215 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 65.52 -85.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.353 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -112.69 -13.34 13.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.137 0.494 . . . . 10.0 111.222 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -90.19 103.12 15.83 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -104.13 123.71 47.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.743 0.306 . . . . 10.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.85 118.42 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.751 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -79.54 121.54 25.36 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.5 m -114.73 122.28 45.93 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.245 0.545 . . . . 10.0 111.969 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.97 102.91 12.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.016 -1.105 . . . . 10.0 108.016 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.51 -166.33 1.62 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.952 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -134.9 161.25 35.76 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -58.27 -28.99 65.45 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -10.97 60.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.1 m -85.67 147.1 26.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.388 -0.227 . . . . 10.0 110.388 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 25.4 p -91.67 164.14 13.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.747 0.308 . . . . 10.0 111.05 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.4 t -67.5 -32.67 58.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 10.0 110.179 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -62.09 -35.97 80.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.343 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.58 -35.41 79.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.883 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.33 -40.82 95.64 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.051 0.453 . . . . 10.0 109.859 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -63.21 -35.36 80.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.082 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -69.46 -33.78 73.42 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.802 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.1 mt -67.62 -44.32 86.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 85.9 t -63.83 -36.1 75.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.32 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -61.76 -37.28 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.815 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.36 -13.36 79.89 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.7 -0.762 . . . . 10.0 112.531 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -104.32 -56.09 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 10.0 111.73 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.72 -11.52 58.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.706 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 58.72 42.93 19.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.85 -0.614 . . . . 10.0 112.455 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 48.4 mtt-85 -129.71 141.47 41.93 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.172 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -53.67 130.97 41.57 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.145 2.563 . . . . 10.0 113.104 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.06 -13.65 34.18 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.98 2.453 . . . . 10.0 112.473 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.47 -37.33 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.413 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -96.22 9.56 40.65 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.42 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -90.08 126.49 35.8 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.775 0.321 . . . . 10.0 111.091 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mmt-85 -119.7 113.15 20.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 94.9 mt -94.09 130.13 40.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.954 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -123.01 122.38 38.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.351 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -124.66 133.95 53.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.18 37.74 23.82 Favored 'General case' 0 C--O 1.234 0.27 0 O-C-N 123.458 0.474 . . . . 10.0 111.543 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 64.9 18.37 11.45 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.43 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -129.17 155.31 45.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.176 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 63.7 tp -76.09 138.51 40.84 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.924 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.49 158.51 17.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.645 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.501 ' CG ' ' H ' ' B' ' 53' ' ' ASP . 8.8 t70 -80.36 -160.85 0.32 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.465 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.501 ' H ' ' CG ' ' B' ' 52' ' ' ASP . 1.0 OUTLIER -135.05 -57.05 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.013 0.435 . . . . 10.0 110.322 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.79 -23.35 64.51 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.645 -0.707 . . . . 10.0 113.087 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -69.71 154.66 41.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.784 0.325 . . . . 10.0 110.581 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 40.9 p -86.97 166.79 14.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.238 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 36.5 mt -60.97 -40.81 94.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.81 -28.4 65.7 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.92 -0.657 . . . . 10.0 112.587 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -84.43 -11.58 55.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.803 0.335 . . . . 10.0 111.309 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 38.9 m -103.77 11.88 35.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.058 0.456 . . . . 10.0 111.915 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.04 8.11 69.43 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.337 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -87.86 90.48 8.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.579 -0.365 . . . . 10.0 110.625 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -122.88 167.93 12.92 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.6 m -67.46 -4.43 11.32 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -89.52 -44.62 9.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.98 -33.94 26.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.248 0.547 . . . . 10.0 109.755 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.18 100.58 10.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.295 -0.866 . . . . 10.0 109.196 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -109.9 158.01 36.14 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.959 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.07 -18.5 63.82 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.439 2.093 . . . . 10.0 111.502 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -107.56 4.69 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.362 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -163.62 86.97 1.24 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.782 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -76.27 146.05 27.89 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.829 2.353 . . . . 10.0 111.332 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 117.01 15.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.109 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.3 m -72.84 126.14 29.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.168 0.509 . . . . 10.0 111.656 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.2 133.19 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.01 134.49 12.67 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.695 -0.764 . . . . 10.0 111.759 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.2 tp -110.88 101.75 10.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.888 0.375 . . . . 10.0 111.167 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.08 101.27 12.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -83.96 113.92 21.33 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.714 -0.476 . . . . 10.0 109.714 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -72.3 94.49 1.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.499 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -111.77 120.42 41.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.955 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.03 144.17 55.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.863 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.08 -5.05 2.02 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.737 0.648 . . . . 10.0 111.985 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m -111.98 104.72 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.012 0.434 . . . . 10.0 110.2 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -76.52 -7.92 56.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.87 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -56.97 -32.96 66.6 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.025 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.08 74.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.852 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.74 -29.68 68.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.665 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 21.3 m -78.9 -21.62 47.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.398 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 27.1 mt -89.22 -18.61 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.25 0.548 . . . . 10.0 109.927 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -80.68 111.93 27.31 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.203 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.48 10.82 1.74 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.935 2.424 . . . . 10.0 112.111 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -91.78 -31.88 15.59 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 13.2 m -116.04 -16.36 11.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.323 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.1 m -128.28 147.26 62.89 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.249 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -73.78 156.77 48.44 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.444 2.096 . . . . 10.0 111.65 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.1 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.548 2.165 . . . . 10.0 111.706 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -59.23 114.98 2.9 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.433 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 22.3 tp -138.92 129.69 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.613 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.65 130.32 32.88 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.768 2.312 . . . . 10.0 111.357 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.08 -35.46 80.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.95 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 22.3 m -67.97 -17.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 90.7 mmm -114.2 13.29 17.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.887 0.375 . . . . 10.0 110.746 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -82.12 -50.04 0.85 Allowed Pre-proline 0 CA--C 1.541 0.61 0 N-CA-C 113.198 0.814 . . . . 10.0 113.198 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -76.92 61.47 7.12 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.128 1.885 . . . . 10.0 112.447 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -130.55 150.53 51.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.536 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.87 158.32 29.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.441 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 37.9 m -73.16 138.6 45.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.374 -0.375 . . . . 10.0 110.407 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.72 -118.07 2.27 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.919 -0.658 . . . . 10.0 112.467 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -114.97 -46.29 2.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.986 0.422 . . . . 10.0 111.059 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 17.5 m -70.87 165.93 22.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.234 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.79 120.12 13.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.197 -0.456 . . . . 10.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.2 t30 68.81 31.09 4.54 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.735 0.647 . . . . 10.0 111.014 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -87.1 135.64 33.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.098 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -114.85 127.24 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.036 0.446 . . . . 10.0 111.38 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -100.91 115.32 30.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.539 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.8 t -73.29 118.08 18.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.415 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.135 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.778 0.323 . . . . 10.0 110.929 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -112.44 117.5 32.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.886 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 39.7 mt -89.21 135.57 33.5 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 35.9 mt -116.5 121.31 67.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 120.845 0.355 . . . . 10.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.85 165.85 13.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.117 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 14.4 m -64.24 -26.6 68.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.688 0.28 . . . . 10.0 111.646 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -75.4 -3.21 32.43 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.149 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.95 10.56 66.44 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.122 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -79.29 139.9 37.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.833 0.349 . . . . 10.0 110.561 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -111.79 133.78 53.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.679 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.81 111.03 15.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.866 0.365 . . . . 10.0 111.687 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 11.2 mm -93.31 115.77 32.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 15.9 t -102.06 142.09 17.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.502 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -62.21 130.89 47.48 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.756 -0.461 . . . . 10.0 109.756 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -48.17 -42.26 29.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 112.176 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.54 -49.19 75.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.965 0.412 . . . . 10.0 111.385 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -68.91 -36.17 77.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.951 0.405 . . . . 10.0 110.397 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.5 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.365 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.6 -47.96 83.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.03 0.443 . . . . 10.0 110.832 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.2 m -62.85 -45.86 90.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.54 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 15.7 m -65.77 -24.37 66.93 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.056 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.78 -6.55 86.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.042 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 41.2 m -88.05 -28.19 21.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.287 0.565 . . . . 10.0 109.855 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -78.11 150.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.241 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.42 96.9 0.26 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.161 0.505 . . . . 10.0 110.652 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -103.67 176.21 5.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.019 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -83.79 31.43 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.57 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.91 -29.84 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.386 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.8 p -90.57 -0.52 57.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.341 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.39 -56.02 8.15 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-N 115.65 -0.705 . . . . 10.0 114.576 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -60.72 -13.02 24.01 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.988 2.459 . . . . 10.0 114.002 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 124.85 -112.05 1.67 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.766 -0.73 . . . . 10.0 111.961 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -100.22 109.88 22.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.94 0.4 . . . . 10.0 110.038 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -86.55 103.84 15.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.818 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.37 167.29 9.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.408 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -52.77 -27.16 16.68 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -57.93 -33.75 69.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.04 0.448 . . . . 10.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -97.77 -24.92 15.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.264 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -64.69 -33.78 76.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.56 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -70.32 -52.54 22.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.176 0.512 . . . . 10.0 109.93 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -133.9 100.57 4.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.406 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 t -80.38 108.22 13.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.19 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -89.44 124.05 34.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.15 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -104.77 128.62 52.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -101.48 140.69 35.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.006 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 60.11 31.45 20.57 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.304 0.573 . . . . 10.0 111.545 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 92.2 mt -131.21 110.79 15.36 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.499 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -68.88 149.49 72.47 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 123.08 2.52 . . . . 10.0 111.925 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.8 p -65.6 -31.71 72.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.749 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -56.27 -54.4 45.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.631 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.58 -33.61 57.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.767 0.318 . . . . 10.0 111.112 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -64.81 -32.97 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.884 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 56.2 m -59.98 -40.63 89.81 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.806 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -68.01 -35.1 77.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.382 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 44.6 t -66.41 -43.8 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.046 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.418 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 69.9 mtm -67.04 -36.45 82.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.229 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -63.83 -42.61 97.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.497 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.79 -46.21 91.37 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.622 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -58.13 -43.31 87.19 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.451 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -66.41 -45.53 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.473 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 tptt -62.5 -40.89 98.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.419 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 41.5 t -58.45 -44.75 89.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.161 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -74.37 -43.74 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.597 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -54.45 -43.47 71.65 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.905 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.93 14.71 13.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.082 0.468 . . . . 10.0 111.808 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -123.44 -62.28 1.33 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.94 0.348 . . . . 10.0 111.94 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 4.7 m -148.83 38.58 0.83 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.092 0.472 . . . . 10.0 110.711 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 19.7 m -147.75 36.0 0.86 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.17 0.51 . . . . 10.0 110.57 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.07 0.93 55.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.435 0.636 . . . . 10.0 110.108 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -75.91 -29.58 58.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.609 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 pt -94.9 159.53 33.0 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.681 -0.691 . . . . 10.0 109.247 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.81 -175.6 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.452 2.101 . . . . 10.0 112.509 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -68.76 175.91 3.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.248 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -52.4 130.59 43.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.508 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.31 116.34 2.77 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.099 2.532 . . . . 10.0 111.813 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 10.2 mt -78.06 72.2 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.395 0.617 . . . . 10.0 111.272 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -120.4 -59.65 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.287 -0.869 . . . . 10.0 111.419 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.71 102.78 1.63 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.597 1.531 . . . . 10.0 111.28 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.51 69.89 2.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.968 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -119.15 10.62 6.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.426 0.631 . . . . 10.0 110.08 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.35 -35.51 65.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 19.7 tp -66.0 -34.96 79.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.13 -33.7 76.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.592 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 90.1 mt -77.2 -34.15 56.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.715 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.2 -12.13 61.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.768 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 47.7 ttp -62.71 -17.42 60.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 10.0 111.465 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.7 -9.75 58.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.781 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.91 -80.62 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 O-C-N 123.826 0.704 . . . . 10.0 112.421 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -101.8 83.7 2.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.522 0.677 . . . . 10.0 111.84 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.317 -0.843 0 N-CA-C 107.626 -1.25 . . . . 10.0 107.626 178.558 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 112.779 -0.128 . . . . 10.0 112.779 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -67.78 -59.66 3.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.769 0.285 . . . . 10.0 111.414 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.85 -24.05 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.053 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -54.81 -46.31 74.51 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.007 0.432 . . . . 10.0 110.399 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -88.97 -33.66 17.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.504 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.7 mt -59.66 -42.54 93.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.774 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.76 -40.52 79.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.899 0.38 . . . . 10.0 110.626 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.4 tp -66.72 -32.29 73.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.268 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.75 -3.43 56.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.607 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.3 -34.01 9.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.068 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.75 118.19 2.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.8 94.13 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -102.04 104.72 38.03 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -93.81 68.95 0.41 Allowed 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.336 2.691 . . . . 10.0 110.214 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -120.93 -175.66 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.129 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -90.62 155.43 18.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.512 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.7 mm -118.3 126.95 75.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.058 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.66 141.45 16.86 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.508 -0.923 . . . . 10.0 108.508 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.07 129.04 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.879 3.053 . . . . 10.0 113.143 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.01 134.62 65.74 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.21 2.607 . . . . 10.0 112.566 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.64 125.96 90.11 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.034 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -68.91 -12.22 33.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.95 2.433 . . . . 10.0 112.179 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -36.84 84.83 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.849 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.58 -114.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.13 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -168.44 53.64 0.05 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.085 0.469 . . . . 10.0 110.958 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -151.17 152.01 32.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.622 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.96 150.94 40.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.719 0.295 . . . . 10.0 110.708 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -92.9 169.58 10.34 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.343 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -120.12 123.4 43.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 10.0 110.408 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.84 -70.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.666 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.0 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.545 -0.909 . . . . 10.0 108.545 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.125 -0.943 . . . . 10.0 109.09 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.777 0.322 . . . . 10.0 111.259 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -107.98 133.91 51.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 10.0 111.776 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 86.8 t -122.48 116.47 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -102.82 118.27 36.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.545 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.31 158.47 39.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.919 0.39 . . . . 10.0 111.501 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 2.0 mtm -127.49 108.08 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.5 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 45.8 mm -81.07 113.43 20.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -109.97 107.03 16.79 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.721 0.637 . . . . 10.0 112.721 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttp85 -96.97 74.29 2.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 68.31 -82.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.267 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -115.61 -9.37 12.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.963 0.411 . . . . 10.0 110.928 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.2 m -93.15 98.66 11.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.82 128.73 44.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.694 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 69.3 mt -123.42 118.54 54.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.79 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -79.05 124.03 27.89 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.6 m -117.72 125.19 50.2 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.144 0.497 . . . . 10.0 111.707 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.73 99.68 9.01 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.01 -164.26 1.1 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.495 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm -130.22 165.36 22.56 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -62.54 -29.53 70.63 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 57.7 m -78.43 -7.62 57.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 15.3 m -76.85 130.27 37.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 36.6 p -82.9 162.34 21.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.72 0.295 . . . . 10.0 110.769 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 78.1 t -63.94 -32.39 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.91 0.386 . . . . 10.0 110.451 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.38 -32.84 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.209 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.56 -33.51 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.435 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.63 -46.0 91.68 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.473 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 91.8 mttt -61.82 -35.5 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.453 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.3 mtp180 -63.24 -38.21 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 10.0 109.998 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.1 -45.21 80.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.791 -0.641 . . . . 10.0 110.065 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.86 -38.57 82.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.419 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -58.93 -37.89 77.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.538 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.51 1.13 83.46 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.966 -0.561 . . . . 10.0 113.028 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 98.9 mt -113.52 -55.13 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.859 0.361 . . . . 10.0 110.772 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.09 -12.32 57.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.543 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt 58.48 49.98 9.92 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.91 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 57.1 mtt-85 -138.94 143.67 38.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.166 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.31 124.26 11.54 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.355 2.703 . . . . 10.0 113.069 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.52 -16.52 27.21 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.804 2.336 . . . . 10.0 111.156 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.42 -29.11 69.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.011 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -98.29 5.49 48.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.893 0.378 . . . . 10.0 111.437 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -88.37 133.21 34.15 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.519 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 49.3 mmt-85 -119.65 114.88 22.87 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.53 120.88 37.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.618 -0.265 . . . . 10.0 110.382 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -117.29 130.41 56.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -135.06 133.97 39.88 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 62.83 29.73 16.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.397 0.436 . . . . 10.0 110.57 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 72.23 6.17 5.47 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.309 -0.859 . . . . 10.0 111.852 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -120.77 161.77 20.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.1 tp -77.85 145.04 36.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.844 0.354 . . . . 10.0 111.319 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 34.9 mt -87.69 151.43 22.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.932 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -97.07 108.51 21.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.124 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.473 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 1.5 m-20 -51.06 -44.34 61.14 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 113.337 0.865 . . . . 10.0 113.337 -178.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -70.58 -7.16 60.56 Favored Glycine 0 CA--C 1.518 0.245 0 CA-C-N 116.13 -0.486 . . . . 10.0 114.226 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -102.6 162.18 13.13 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 117.107 0.453 . . . . 10.0 111.106 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 38.2 p -90.73 167.23 12.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.081 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 33.7 mt -59.93 -40.95 90.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.621 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.54 -37.23 88.21 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.055 -0.593 . . . . 10.0 112.201 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.96 -9.85 59.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.647 0.26 . . . . 10.0 111.512 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.6 m -102.71 8.66 39.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.987 0.422 . . . . 10.0 111.036 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.95 65.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.29 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -87.08 76.79 9.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.94 0.4 . . . . 10.0 110.334 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.23 155.56 17.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.165 -0.471 . . . . 10.0 109.762 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 5.1 m -66.08 -11.97 52.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 10.0 111.376 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -75.76 -28.36 58.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.018 0.437 . . . . 10.0 110.465 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.25 -48.49 4.37 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.08 82.02 6.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.204 -0.907 . . . . 10.0 109.307 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -94.4 158.88 34.97 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.963 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.95 -16.08 51.8 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.537 2.158 . . . . 10.0 111.925 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -105.69 2.92 28.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.411 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -160.83 82.98 2.01 Favored Pre-proline 0 C--O 1.233 0.235 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.878 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.41 132.57 25.93 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.712 2.275 . . . . 10.0 111.473 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.54 119.53 8.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.784 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.93 124.45 26.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.928 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.0 130.89 74.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.53 131.19 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.709 -0.758 . . . . 10.0 111.924 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.4 tp -113.9 110.75 20.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.422 . . . . 10.0 111.363 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -106.79 124.38 49.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.683 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -105.41 114.08 28.04 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 -71.64 113.53 8.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.031 0.443 . . . . 10.0 111.243 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -127.73 130.1 48.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.563 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . 0.411 ' C ' ' H ' ' B' ' 84' ' ' THR . 39.0 t70 -59.95 134.9 57.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.409 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.7 t70 71.27 -10.44 0.79 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.336 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.411 ' H ' ' C ' ' B' ' 82' ' ' ASP . 5.0 m -100.03 100.39 11.26 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.167 0.508 . . . . 10.0 110.276 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -77.21 1.13 19.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.7 -0.682 . . . . 10.0 112.28 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.29 -33.01 68.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.943 0.401 . . . . 10.0 110.27 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.14 82.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.238 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 91.0 mt -75.32 -7.09 53.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.567 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 18.6 m -96.85 -27.88 14.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.061 0.458 . . . . 10.0 110.344 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -88.07 -31.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.481 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.27 114.65 14.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.573 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -63.3 -22.37 72.1 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.091 2.527 . . . . 10.0 111.827 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -67.95 -26.75 66.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.267 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -106.57 -40.0 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.881 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 74.1 m -128.82 136.16 28.72 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.539 0.209 . . . . 10.0 110.941 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.43 155.38 62.7 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.709 2.273 . . . . 10.0 111.812 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.19 133.32 41.43 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.107 2.538 . . . . 10.0 112.591 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.57 104.45 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.856 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 33.4 tp -131.19 124.21 20.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.221 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.55 138.08 73.39 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.812 2.341 . . . . 10.0 111.923 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.11 -38.74 87.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.003 0.43 . . . . 10.0 111.309 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.8 m -65.25 -18.23 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.241 0.543 . . . . 10.0 111.049 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.7 mmm -113.81 44.34 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 70.1 tttt -120.29 -51.26 0.04 OUTLIER Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.631 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.42 55.26 4.11 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.223 1.949 . . . . 10.0 112.48 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -127.25 148.78 50.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.244 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -74.77 160.11 31.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 17.8 m -90.31 136.49 33.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.478 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.98 -135.05 2.34 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.187 -0.53 . . . . 10.0 113.262 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.62 -53.08 4.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.861 0.363 . . . . 10.0 111.376 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 23.7 m -70.64 159.81 33.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.398 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.42 127.12 30.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.989 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 t30 71.95 17.79 5.15 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.806 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.41 120.12 21.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -100.32 124.28 45.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.072 0.463 . . . . 10.0 111.258 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.59 97.1 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.86 128.29 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.303 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.974 179.88 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.234 0.244 0 CA-C-O 120.902 0.382 . . . . 10.0 110.828 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -105.29 107.57 18.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.742 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -91.33 113.64 25.96 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 5.5 mt -102.89 122.91 55.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.601 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.0 p -94.38 167.66 11.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -9.37 29.18 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.099 0.407 . . . . 10.0 112.099 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -86.61 -4.83 59.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.134 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.99 17.57 69.55 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.253 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.45 126.17 39.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -94.95 134.31 37.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.717 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -123.4 104.89 9.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.77 0.319 . . . . 10.0 111.106 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 24.4 mm -88.69 115.75 29.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.403 -0.591 . . . . 10.0 109.403 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 41.8 t -105.86 127.78 60.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.622 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -54.99 129.4 37.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.29 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 32.4 ttt-85 -57.45 -30.86 65.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 10.0 112.038 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.16 -43.15 73.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.052 0.453 . . . . 10.0 110.644 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -81.33 -41.74 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.614 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.26 -33.78 65.79 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.733 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 50.9 mt -59.35 -44.93 92.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.85 0.357 . . . . 10.0 110.379 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 4.2 m -65.25 -46.42 80.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.417 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -37.43 86.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.924 0.392 . . . . 10.0 110.524 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.47 -17.77 74.82 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 116.064 -0.516 . . . . 10.0 112.09 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -80.65 -25.93 37.99 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 41.3 mt -79.41 154.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.413 -0.812 . . . . 10.0 108.931 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -71.8 87.64 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.006 0.432 . . . . 10.0 111.319 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.49 179.69 5.45 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.316 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.29 36.02 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.986 0.422 . . . . 10.0 111.48 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 9.9 tp -66.98 -31.71 72.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.326 0.584 . . . . 10.0 109.845 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 9.72 24.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.348 -0.842 . . . . 10.0 110.589 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.61 -64.47 3.69 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.877 -0.602 . . . . 10.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.61 177.11 7.22 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.694 2.262 . . . . 10.0 111.477 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.19 -77.6 0.27 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.969 -0.634 . . . . 10.0 112.215 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -117.21 116.88 28.14 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 10.0 110.521 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -95.3 89.87 5.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.82 164.43 26.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.198 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.8 -26.52 58.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.023 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -59.11 -52.76 64.34 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -72.63 -20.28 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.319 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 7.1 m -71.76 -29.6 64.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 10.0 110.69 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -93.03 -33.46 14.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.732 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -135.5 98.81 4.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.04 0.447 . . . . 10.0 110.301 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 t -90.38 132.4 35.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.314 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -106.44 115.15 29.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.478 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -104.1 112.88 26.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.511 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -102.86 148.19 25.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.15 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 70.13 14.59 7.69 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.687 0.617 . . . . 10.0 110.725 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 69.5 mt -125.19 108.27 27.41 Favored Pre-proline 0 N--CA 1.455 -0.203 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.38 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.24 150.75 83.19 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.122 2.548 . . . . 10.0 112.384 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.2 p -61.46 -39.81 92.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -52.86 -56.52 15.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 10.0 112.66 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 m -65.2 -35.9 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.929 -0.308 . . . . 10.0 111.255 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -66.0 -35.21 79.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -61.19 -43.32 99.07 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.37 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -65.92 -35.85 81.77 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.218 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 78.4 t -64.12 -46.51 93.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.539 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.8 -42.52 99.11 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.624 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.53 -37.8 83.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.664 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -63.73 -44.03 94.76 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.995 -0.372 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -62.9 -44.21 96.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 58.6 m -57.83 -45.02 86.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.321 0.581 . . . . 10.0 109.783 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -65.56 -44.84 85.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.072 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -60.49 -40.64 92.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.296 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.0 -48.48 84.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.458 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -74.01 -39.01 63.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.242 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -58.01 -45.57 86.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.416 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.41 23.95 2.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.131 0.491 . . . . 10.0 110.667 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -128.86 -62.41 1.01 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.57 -25.52 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -83.61 34.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.275 0.472 . . . . 10.0 112.275 -179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -6.5 59.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.567 0.698 . . . . 10.0 109.658 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -65.87 -26.48 67.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.738 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 23.0 pt -102.77 164.72 15.02 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.639 . . . . 10.0 109.437 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.8 -170.85 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.458 2.105 . . . . 10.0 112.717 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -72.09 165.88 23.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.655 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -48.66 128.15 13.77 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 123.463 0.477 . . . . 10.0 111.011 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -50.14 121.89 8.34 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 123.104 2.536 . . . . 10.0 112.586 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 19.7 pt -79.04 52.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.669 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.34 -56.47 0.16 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.182 -0.463 . . . . 10.0 112.214 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.21 117.4 5.09 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.616 1.544 . . . . 10.0 111.022 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -73.67 -2.61 23.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 39.7 mm -81.62 72.73 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.594 0.711 . . . . 10.0 110.604 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -137.89 -38.23 0.58 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.218 -0.901 . . . . 10.0 109.424 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 12.0 tp -67.97 -24.73 65.19 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.945 -0.761 . . . . 10.0 108.945 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -62.98 -31.76 72.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.699 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 54.6 mt -77.66 -32.4 53.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.649 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -22.09 63.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.386 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.1 ttp -66.6 -19.71 65.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.332 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.68 -34.28 77.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.986 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.39 -56.97 0.5 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.959 0.787 . . . . 10.0 112.54 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -82.49 41.31 0.7 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.144 0.497 . . . . 10.0 110.592 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.241 0.647 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 112.475 -0.25 . . . . 10.0 112.475 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -65.22 0.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.2 tp -61.31 -30.96 70.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.022 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -54.73 -29.7 54.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.944 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -105.09 -37.32 6.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.587 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.6 mt -64.06 -44.6 91.96 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.12 -30.32 66.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 10.0 111.298 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.8 tp -66.27 -35.69 81.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.163 0.506 . . . . 10.0 110.254 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.28 -2.43 52.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.002 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -100.99 -23.2 14.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.3 tp -169.46 109.77 0.44 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.099 -0.5 . . . . 10.0 111.075 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.8 mt -82.92 83.69 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -92.35 111.37 50.15 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.394 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -91.97 38.82 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.12 2.547 . . . . 10.0 112.554 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -93.48 166.13 12.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.772 0.32 . . . . 10.0 110.844 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -82.93 156.54 23.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -106.67 143.7 17.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.287 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.31 140.77 11.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -36.08 131.52 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.802 3.001 . . . . 10.0 113.052 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.18 144.05 91.56 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.432 2.755 . . . . 10.0 113.25 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mt -75.41 122.02 86.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.896 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.81 -23.28 75.89 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 123.037 2.492 . . . . 10.0 112.897 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -31.18 72.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.151 0.5 . . . . 10.0 110.47 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.46 -139.33 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.227 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -149.89 60.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.329 0.585 . . . . 10.0 110.352 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.4 tttm -154.64 150.55 27.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.894 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.98 152.65 41.27 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.837 0.351 . . . . 10.0 111.453 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 m -90.32 168.37 11.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.837 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -114.49 107.75 15.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.782 0.325 . . . . 10.0 110.68 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -157.94 -82.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.337 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.6 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 O-C-N 123.482 0.489 . . . . 10.0 110.614 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.294 -0.86 . . . . 10.0 110.689 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.3 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.935 0.398 . . . . 10.0 110.512 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -77.7 135.55 38.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.406 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 94.4 t -120.67 118.84 57.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.991 0.424 . . . . 10.0 110.563 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -106.19 112.01 24.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.057 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.37 158.8 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.82 0.343 . . . . 10.0 111.179 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 34.9 mtm -127.0 107.28 9.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.636 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.6 mm -78.43 106.33 8.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -101.75 101.52 12.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.259 0.552 . . . . 10.0 112.487 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.6 ttp85 -91.72 72.56 5.81 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.377 -1.342 . . . . 10.0 107.377 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 67.6 -80.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.075 -177.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 58.1 mttt -116.02 -5.46 11.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.97 0.414 . . . . 10.0 111.132 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.0 m -96.58 94.6 7.44 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 2.9 m -95.86 112.31 24.07 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.939 0.4 . . . . 10.0 110.851 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 44.8 mt -106.37 116.8 50.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.988 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -77.15 116.83 18.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -112.1 112.29 23.8 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.335 0.588 . . . . 10.0 111.854 -178.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -100.76 103.48 14.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.432 -1.321 . . . . 10.0 107.432 178.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.13 -164.39 1.28 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.314 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -125.4 153.55 43.24 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.23 -27.35 61.95 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.169 0.433 . . . . 10.0 112.169 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -8.6 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 16.4 m -84.4 147.61 27.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.622 0.249 . . . . 10.0 110.704 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 8.2 p -92.42 163.47 13.84 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.313 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 83.5 t -64.0 -36.71 77.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.591 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.17 -32.51 71.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.3 -31.59 71.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.066 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.26 -42.38 99.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.507 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 94.9 mttt -62.95 -37.35 86.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.061 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -61.84 -43.22 99.29 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.968 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.09 -48.93 81.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.093 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.6 t -61.14 -36.45 72.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.758 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.66 -35.02 75.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.148 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.72 -18.52 72.81 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.574 -0.822 . . . . 10.0 112.276 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.3 mt -92.21 -53.46 8.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.749 0.309 . . . . 10.0 111.226 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.4 mt -84.08 -13.28 53.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 mttt 63.01 32.58 15.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.675 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -121.0 138.83 28.3 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.24 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -50.33 135.08 39.07 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.314 2.676 . . . . 10.0 112.895 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -74.02 -16.1 23.04 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.037 2.491 . . . . 10.0 112.521 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.78 -35.99 79.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.027 -0.533 . . . . 10.0 112.028 -178.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -101.49 16.99 23.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -92.29 124.42 36.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.1 mmt-85 -112.24 114.05 26.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.438 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -98.21 113.35 25.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.333 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -112.21 122.59 48.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.696 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 30.5 tttm -124.99 130.29 52.06 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.17 35.83 18.31 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.472 0.482 . . . . 10.0 110.488 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 68.94 12.43 8.62 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.212 -0.904 . . . . 10.0 112.908 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -129.12 157.29 42.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.884 0.373 . . . . 10.0 111.496 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.35 143.35 33.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.405 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 93.6 mt -93.05 156.68 16.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.243 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.2 t0 -92.98 119.88 32.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.788 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.507 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 9.7 m-20 -57.57 -31.89 66.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.056 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.01 -3.74 90.64 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.611 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -101.1 153.72 19.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.47 . . . . 10.0 111.59 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 28.8 p -88.4 167.97 13.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.197 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 67.8 mt -60.49 -42.83 97.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 10.0 110.74 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.44 -41.52 98.62 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.622 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.24 -29.29 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.312 . . . . 10.0 111.686 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.7 m -79.85 -5.73 56.03 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.93 10.03 41.11 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.584 -0.817 . . . . 10.0 113.312 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -79.96 67.39 5.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.179 0.514 . . . . 10.0 110.828 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.51 155.16 23.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.053 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -26.32 63.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.0 0.428 . . . . 10.0 111.728 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.11 -26.51 64.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.399 . . . . 10.0 110.917 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.69 -51.91 4.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.616 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.45 95.86 10.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.502 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -109.8 156.14 40.33 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.084 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.26 -14.36 37.55 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.306 2.004 . . . . 10.0 110.407 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.44 -7.4 21.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.995 -1.002 . . . . 10.0 109.956 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -160.87 88.61 1.69 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.363 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -74.25 147.74 37.91 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.732 2.288 . . . . 10.0 111.58 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.86 110.27 10.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.999 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.59 119.37 14.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.715 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 41.4 t -115.7 134.83 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.72 126.61 7.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.479 -0.867 . . . . 10.0 112.169 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 23.6 tp -111.12 105.6 14.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.908 0.385 . . . . 10.0 111.049 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.64 124.72 50.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.651 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -95.77 119.0 33.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.797 0.332 . . . . 10.0 110.116 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 18.9 ttp180 -79.66 78.8 6.2 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.923 -0.581 . . . . 10.0 111.099 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -98.52 129.65 45.09 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.692 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -68.18 150.08 48.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.988 -0.551 . . . . 10.0 109.768 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 70.11 7.62 6.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.561 0.538 . . . . 10.0 110.832 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 7.0 m -123.12 132.89 54.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.141 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -100.46 -4.26 29.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.43 . . . . 10.0 111.011 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.05 -24.63 67.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.686 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.98 74.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.871 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.65 -14.38 60.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.807 0.336 . . . . 10.0 111.666 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 51.2 m -84.18 -28.31 27.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.134 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 22.6 mt -94.51 -25.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.531 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -69.41 112.63 12.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.67 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -72.0 -10.95 26.84 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.262 2.642 . . . . 10.0 111.416 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -74.85 -33.17 62.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.243 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -102.51 -40.17 6.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.549 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -119.43 142.63 32.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.535 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.38 152.97 80.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.765 2.31 . . . . 10.0 111.99 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.43 126.35 22.18 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.084 2.522 . . . . 10.0 112.193 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -66.14 112.71 4.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.787 -0.642 . . . . 10.0 111.77 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 32.2 tp -139.34 120.57 9.77 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.498 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.84 128.59 31.08 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.069 2.513 . . . . 10.0 112.076 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -59.62 -31.78 69.81 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.949 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 19.3 m -71.03 -17.55 20.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.19 0.519 . . . . 10.0 111.338 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 81.0 mmm -122.56 58.29 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -135.02 -54.48 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.492 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -75.55 60.36 5.81 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.612 2.208 . . . . 10.0 112.218 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -123.44 -156.68 0.72 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.157 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -113.15 172.53 6.89 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.923 -0.311 . . . . 10.0 110.443 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 15.9 m -99.97 136.28 40.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.058 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.34 -144.99 9.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.563 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -35.95 11.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.925 0.393 . . . . 10.0 110.655 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 49.9 m -80.59 158.37 25.75 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.382 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.65 123.71 20.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.908 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 73.17 5.6 5.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.761 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -71.6 131.5 43.3 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -110.36 138.93 46.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.077 0.465 . . . . 10.0 111.529 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -108.88 111.21 22.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.807 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -81.17 123.94 38.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.754 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.176 179.702 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.147 0.498 . . . . 10.0 110.798 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -108.88 122.83 48.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.91 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 25.1 mt -101.32 120.46 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.534 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.65 115.81 48.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.112 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -87.13 173.69 9.09 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.919 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.9 m -68.17 -21.19 64.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.244 0.545 . . . . 10.0 110.704 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.81 -8.4 56.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.685 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.41 12.09 73.71 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.573 -0.822 . . . . 10.0 111.461 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.04 134.46 35.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -103.56 106.93 17.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.265 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -98.31 109.99 22.65 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.714 0.292 . . . . 10.0 111.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 14.6 mm -94.38 112.81 27.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.39 133.74 42.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.718 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -59.3 128.64 38.12 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -53.88 -35.19 61.3 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.239 0.337 . . . . 10.0 111.674 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -56.74 -40.28 75.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.145 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -86.32 -33.33 20.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.066 0.46 . . . . 10.0 110.084 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.86 -40.04 93.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.344 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.34 -47.18 86.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.309 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.32 -40.06 93.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.691 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -65.29 -36.72 84.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.167 0.508 . . . . 10.0 109.824 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.27 -6.58 86.46 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.268 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -79.12 -27.33 42.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -83.38 143.32 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -66.49 95.42 0.32 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.471 . . . . 10.0 111.317 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.85 -171.3 2.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.144 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 91.8 mmm -79.59 31.81 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.847 0.356 . . . . 10.0 111.952 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 16.3 tp -66.17 -39.23 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.316 0.579 . . . . 10.0 110.016 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.51 7.04 24.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.593 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.95 -64.72 3.71 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.655 -0.702 . . . . 10.0 112.583 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.99 173.4 8.39 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.473 2.116 . . . . 10.0 111.666 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.96 -63.64 5.14 Favored Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.968 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -140.04 125.02 18.5 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.892 0.377 . . . . 10.0 110.134 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -88.25 110.16 20.51 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.287 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.5 152.82 28.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.218 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.33 -33.93 75.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.231 0.539 . . . . 10.0 109.737 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.58 -35.78 78.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.34 -0.846 . . . . 10.0 109.545 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -77.36 -22.84 51.12 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.452 -0.795 . . . . 10.0 110.023 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -73.86 -34.31 64.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.19 0.519 . . . . 10.0 109.739 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -70.73 -47.26 60.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.756 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -133.0 97.22 3.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.743 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.5 t -83.11 125.77 40.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.07 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -94.14 111.34 23.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.935 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -102.08 110.7 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.399 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -101.06 144.9 29.42 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.799 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 69.71 22.7 6.02 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.86 0.725 . . . . 10.0 110.491 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 76.6 mt -131.51 107.21 14.43 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.335 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -64.72 156.64 60.38 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 123.069 2.513 . . . . 10.0 112.249 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.6 p -69.12 -34.89 75.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.577 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -35.77 76.47 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.688 0.625 . . . . 10.0 112.688 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 32.9 m -87.37 -31.37 5.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.401 -0.52 . . . . 10.0 111.209 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.68 -33.89 75.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.277 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -40.59 98.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.823 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -64.49 -37.97 89.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.249 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.83 -46.25 94.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.83 -43.19 98.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.852 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.16 -38.78 91.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.874 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -64.6 -42.88 95.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.525 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -62.37 -44.86 95.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.541 . . . . 10.0 109.912 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 29.1 m -60.0 -43.3 95.28 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.992 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -63.65 -42.17 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.173 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 12.6 tptt -64.3 -37.27 86.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.131 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.28 -50.31 80.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -70.78 -31.27 67.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.442 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -62.52 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.091 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -75.7 -15.94 60.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.966 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.04 -55.77 4.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.945 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.5 p -145.95 -34.31 0.31 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.693 0.627 . . . . 10.0 112.693 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 9.8 m -78.4 44.4 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.106 0.479 . . . . 10.0 112.216 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -18.35 26.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.552 0.691 . . . . 10.0 109.796 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -89.1 8.46 29.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.513 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 pt -111.21 163.92 16.2 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.14 149.9 82.34 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.466 2.111 . . . . 10.0 112.676 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -70.66 165.45 22.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.32 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -45.31 128.66 5.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.285 0.365 . . . . 10.0 111.151 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.76 5.4 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.077 2.518 . . . . 10.0 112.482 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 7.2 pt -79.54 57.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.5 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.8 -55.22 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.483 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -58.47 107.59 0.34 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.987 1.791 . . . . 10.0 112.187 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -72.61 57.02 0.4 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.761 -0.654 . . . . 10.0 112.6 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mm -125.24 -4.35 5.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.348 0.594 . . . . 10.0 109.919 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.7 68.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.783 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 29.8 tp -67.1 -29.9 69.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.379 0.609 . . . . 10.0 109.425 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 -64.23 -34.74 78.8 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.459 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 89.4 mt -76.47 -27.82 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.265 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 94.6 mt -73.06 -15.69 61.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.776 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 51.9 ttp -61.91 -26.12 67.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.695 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.69 83.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.76 -58.21 0.44 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.902 0.751 . . . . 10.0 112.59 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -82.65 50.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.516 0.674 . . . . 10.0 110.337 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.87 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.76 -0.136 . . . . 10.0 112.76 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -68.63 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.69 0.626 . . . . 10.0 112.69 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.3 -21.67 66.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -51.73 -31.96 28.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.335 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -115.49 -35.0 4.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.007 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -63.0 -36.07 82.34 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.546 0.573 . . . . 10.0 112.546 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.54 72.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.682 0.277 . . . . 10.0 111.257 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.1 tp -68.31 -32.04 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.162 0.506 . . . . 10.0 110.667 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.07 -18.1 50.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.741 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 -11.68 29.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.055 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.7 tp -165.21 113.56 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.221 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.8 mt -90.14 78.72 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -107.37 102.55 44.58 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.643 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -91.99 53.1 0.69 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.946 2.431 . . . . 10.0 111.697 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -100.63 -177.15 3.4 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.918 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -86.77 152.7 22.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.767 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.8 mm -120.49 105.92 17.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.679 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.442 ' HZ1' ' C ' ' A' ' 37' ' ' TRP . 4.4 tttp -120.2 146.23 42.03 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -32.87 133.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 124.227 3.285 . . . . 10.0 113.5 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -62.24 155.27 57.73 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 123.216 2.611 . . . . 10.0 113.401 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 122.96 63.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.477 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.78 -16.11 51.27 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.457 2.771 . . . . 10.0 112.893 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -42.26 98.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 10.0 110.121 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 t -120.99 -113.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.709 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -171.9 57.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.062 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.3 tttm -152.8 151.92 31.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.134 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.8 pp -72.0 156.28 39.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.683 0.277 . . . . 10.0 110.977 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -96.43 161.82 13.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.475 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -101.69 124.95 48.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.657 -0.498 . . . . 10.0 109.657 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -174.91 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.109 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.7 -64.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.516 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.442 ' C ' ' HZ1' ' A' ' 23' ' ' LYS . 2.0 m0 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.141 -0.933 . . . . 10.0 109.281 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmm . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 120.831 0.348 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -177.93 104.1 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.657 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 55.5 t -119.56 123.66 71.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.282 0.563 . . . . 10.0 111.78 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.01 116.67 31.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.237 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.65 151.33 48.2 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.182 0.515 . . . . 10.0 112.326 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 41.7 mtm -122.3 104.58 9.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.137 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.7 mm -81.75 104.24 10.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.58 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -101.54 104.31 15.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.0 ttp85 -91.93 69.79 5.48 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 66.98 -79.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.343 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -110.03 -11.29 14.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.643 0.259 . . . . 10.0 111.345 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 102.93 12.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.646 -0.252 . . . . 10.0 110.887 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 17.8 m -101.72 124.29 47.12 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.872 0.368 . . . . 10.0 110.914 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 53.1 mt -116.41 122.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.987 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -84.66 122.65 29.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.851 0.358 . . . . 10.0 110.144 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -117.96 130.17 56.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.491 . . . . 10.0 111.634 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -110.74 103.89 12.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.97 -168.65 2.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.453 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -129.49 161.22 30.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -54.26 -28.13 39.56 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.5 m -68.08 -25.43 65.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.4 m -73.24 137.4 44.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.619 0.247 . . . . 10.0 110.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -87.98 167.28 13.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.875 0.369 . . . . 10.0 111.181 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.1 -35.53 75.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.19 -34.96 77.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.172 0.51 . . . . 10.0 110.517 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.38 -31.17 71.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.847 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 mt -66.32 -43.98 84.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 10.0 109.949 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.439 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 87.1 mttt -61.07 -34.66 75.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.43 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -67.96 -32.96 73.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.447 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -69.5 -46.69 75.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -63.48 -35.07 71.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -60.53 -38.03 83.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.291 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.15 1.05 71.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.729 -0.748 . . . . 10.0 112.946 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.56 -56.05 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.891 0.377 . . . . 10.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.75 -13.72 44.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.503 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.9 mttt 61.7 31.64 18.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.728 -0.669 . . . . 10.0 112.166 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -105.04 142.86 25.53 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.654 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.16 125.22 17.48 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.893 2.395 . . . . 10.0 112.496 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -64.11 -21.36 67.91 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.953 2.435 . . . . 10.0 112.322 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.31 -29.75 70.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -96.11 -4.07 43.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.78 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.9 135.19 35.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.935 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -127.14 110.21 12.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.115 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.81 111.66 23.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.904 0.383 . . . . 10.0 110.661 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -107.44 109.95 21.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.758 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -118.52 134.01 55.42 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 62.35 32.0 17.1 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.253 0.549 . . . . 10.0 109.715 -178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 67.93 10.54 7.87 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.021 -0.991 . . . . 10.0 112.066 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -124.59 151.37 44.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.017 0.437 . . . . 10.0 111.303 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.8 tp -74.83 126.44 30.95 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.185 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.48 153.54 41.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.899 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -93.1 112.34 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.961 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.439 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 1.7 m-20 -60.31 -27.24 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.137 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.66 -12.79 83.25 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.942 -0.647 . . . . 10.0 112.714 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -102.27 161.49 13.66 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.876 0.369 . . . . 10.0 111.038 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.6 p -90.97 172.9 8.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.885 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.39 -29.61 70.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.525 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.49 -43.96 98.63 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.131 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -75.08 -15.21 60.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.76 0.282 . . . . 10.0 111.76 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 53.5 m -95.84 15.35 20.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.825 0.345 . . . . 10.0 111.782 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.37 41.56 96.46 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.017 -0.611 . . . . 10.0 113.115 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -101.97 48.62 0.87 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.002 0.43 . . . . 10.0 110.228 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.01 149.79 49.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.512 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -22.69 65.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.977 0.418 . . . . 10.0 111.717 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.2 mm-40 -72.81 -32.03 65.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.066 0.46 . . . . 10.0 110.418 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.81 -37.97 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.797 179.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.5 92.14 3.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.508 -0.769 . . . . 10.0 109.138 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -106.74 163.5 16.85 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.23 -16.27 53.97 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.334 2.023 . . . . 10.0 111.2 178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.34 1.28 23.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.613 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.8 82.84 1.79 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.577 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -74.88 143.43 29.48 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.923 2.416 . . . . 10.0 111.987 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.77 118.05 13.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.805 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.76 123.26 26.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.44 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 34.9 t -122.99 136.32 60.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.26 134.38 12.4 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.73 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.47 102.76 10.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.897 0.38 . . . . 10.0 111.838 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.43 130.74 38.02 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -111.59 116.48 30.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.629 0.252 . . . . 10.0 110.998 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -70.99 104.25 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.179 0.514 . . . . 10.0 111.005 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.01 126.97 49.72 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.804 -0.634 . . . . 10.0 109.367 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -66.29 133.27 50.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.953 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 76.26 -22.38 0.28 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.265 0.839 . . . . 10.0 113.265 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.4 m -85.25 106.39 16.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.994 0.426 . . . . 10.0 110.429 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -77.51 -4.36 45.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.163 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -60.07 -30.95 69.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.916 0.388 . . . . 10.0 110.897 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.54 -34.2 66.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.964 -0.562 . . . . 10.0 112.471 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.76 -30.04 69.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.4 m -79.6 -12.35 59.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.701 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 mt -100.29 -0.85 10.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 10.0 111.098 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -97.81 110.89 57.36 Favored Pre-proline 0 C--N 1.323 -0.553 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.009 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -70.73 2.49 4.02 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.257 2.638 . . . . 10.0 112.383 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -94.1 -18.67 21.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.213 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.4 p -118.94 -42.11 2.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.165 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.3 m -106.52 153.33 40.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.991 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.04 159.09 23.91 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.382 2.055 . . . . 10.0 111.366 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.66 126.23 20.01 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.585 2.19 . . . . 10.0 111.591 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -70.99 103.81 2.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.505 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.6 tp -131.38 126.54 21.33 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.447 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.67 134.07 60.4 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.819 2.346 . . . . 10.0 111.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.01 -37.64 88.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.272 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.6 m -73.51 -15.95 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.324 0.583 . . . . 10.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 89.7 mmm -112.78 39.14 2.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.508 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -115.76 -53.74 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.169 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -73.11 69.77 3.85 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 122.314 2.01 . . . . 10.0 111.553 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -137.1 170.68 15.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.608 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -85.63 175.54 8.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.785 0.326 . . . . 10.0 110.794 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.3 m -96.63 143.65 27.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.348 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.18 -153.21 29.67 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.213 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -33.73 13.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.212 0.529 . . . . 10.0 110.877 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.8 m -89.09 163.41 15.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.879 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.61 132.13 45.72 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.041 -0.725 . . . . 10.0 109.041 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.85 -0.28 3.41 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.709 0.63 . . . . 10.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -76.49 131.61 39.11 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -115.48 151.33 34.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.053 0.454 . . . . 10.0 111.365 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -118.21 106.02 12.38 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.046 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.52 127.86 32.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.809 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.412 179.652 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.134 0.492 . . . . 10.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -105.42 121.93 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.586 -0.734 . . . . 10.0 110.847 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 39.1 mt -95.7 115.06 26.88 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 3.9 mt -98.7 109.78 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.5 p -83.33 170.82 14.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.73 0.3 . . . . 10.0 110.975 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.1 m -67.84 -19.8 65.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.886 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -82.91 -4.87 58.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.079 0.466 . . . . 10.0 110.296 179.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.22 65.57 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.406 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.96 130.49 34.53 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -95.17 117.16 29.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.238 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.25 106.47 16.65 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.686 0.279 . . . . 10.0 110.882 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 mm -94.34 116.54 35.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.63 136.17 43.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.591 0.234 . . . . 10.0 110.88 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -58.62 129.37 41.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -57.94 -25.53 61.04 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 112.683 0.623 . . . . 10.0 112.683 -178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -55.17 -49.81 70.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.198 0.523 . . . . 10.0 110.149 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -77.95 -32.14 51.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.864 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -37.22 86.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.342 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 64.8 mt -59.98 -52.4 65.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.978 0.418 . . . . 10.0 110.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 1.7 m -62.1 -44.21 97.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.973 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.6 m -62.1 -38.78 90.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.996 0.427 . . . . 10.0 110.848 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.29 -10.11 78.16 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.066 -0.588 . . . . 10.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 23.6 m -86.5 -25.17 25.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.249 0.547 . . . . 10.0 109.582 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 mt -75.1 170.61 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.883 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -73.29 78.33 1.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 10.0 110.681 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.14 9.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.796 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.31 45.18 0.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.712 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tt -70.24 -37.5 74.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.045 0.45 . . . . 10.0 110.233 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.73 12.91 13.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.841 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.3 -60.97 6.13 Favored Glycine 0 CA--C 1.523 0.537 0 CA-C-N 115.789 -0.641 . . . . 10.0 113.027 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -67.91 -178.31 1.61 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.621 2.214 . . . . 10.0 112.253 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.3 -49.08 68.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.891 -0.671 . . . . 10.0 112.158 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -149.69 133.38 16.81 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.23 100.8 12.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.032 0.444 . . . . 10.0 110.352 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.48 159.13 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.042 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.3 -28.59 63.19 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -61.83 -42.54 99.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.046 0.45 . . . . 10.0 110.083 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -72.8 -20.29 61.18 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -79.78 -32.0 40.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.209 0.528 . . . . 10.0 109.621 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -75.04 -51.05 14.51 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -131.55 106.63 8.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.76 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.3 t -92.82 115.07 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.535 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -90.15 113.75 25.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.979 0.419 . . . . 10.0 111.176 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -102.26 103.13 13.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.89 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -92.35 148.44 22.13 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 69.1 17.57 8.45 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.808 0.693 . . . . 10.0 110.716 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.84 108.17 16.91 Favored Pre-proline 0 C--O 1.237 0.425 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.793 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.33 149.39 91.36 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.069 2.512 . . . . 10.0 112.504 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 6.4 p -62.77 -40.07 96.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.576 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.72 -53.15 58.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 10.0 112.257 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.21 -34.47 66.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.904 -0.319 . . . . 10.0 111.217 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.17 -30.8 71.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.946 0.403 . . . . 10.0 110.332 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -62.97 -40.57 98.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.499 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -68.1 -35.13 77.66 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.284 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.18 -46.32 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.619 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.31 -41.59 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.902 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 63.3 mtm -65.66 -40.76 92.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.914 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.28 -42.22 96.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.603 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -62.94 -44.5 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.278 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 43.4 m -58.88 -43.09 90.86 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.488 0.661 . . . . 10.0 109.794 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.59 -43.43 84.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.117 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . 0.426 ' HZ3' ' CD ' ' C' ' 74' ' ' GLU . 1.9 tpmt? -61.42 -39.68 91.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.362 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.43 -45.03 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.416 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -77.31 -38.83 49.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.72 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.21 -52.39 63.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.491 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.7 50.59 1.92 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.599 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -158.56 -54.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.438 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -139.77 -38.08 0.48 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.279 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 40.18 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.917 0.389 . . . . 10.0 111.769 -179.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.7 -8.03 56.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.291 0.567 . . . . 10.0 110.244 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -79.72 -27.71 40.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.149 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 27.5 pt -92.22 165.3 20.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.842 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -73.68 -178.33 3.68 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.329 2.019 . . . . 10.0 113.422 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . 0.426 ' CD ' ' HZ3' ' C' ' 62' ' ' LYS . 12.4 tp10 -78.58 173.37 12.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.32 -0.854 . . . . 10.0 108.907 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.31 129.77 51.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 123.104 0.252 . . . . 10.0 110.445 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.3 123.02 10.35 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.121 2.548 . . . . 10.0 112.534 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 23.0 pt -82.09 38.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.494 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.57 -57.03 0.24 Allowed Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 10.0 112.081 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.78 103.48 0.71 Allowed 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.119 1.879 . . . . 10.0 111.189 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -76.71 51.93 0.79 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.708 0.633 . . . . 10.0 112.708 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 27.8 mm -118.34 -9.18 11.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.479 0.657 . . . . 10.0 110.096 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.3 -29.31 66.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.255 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 11.6 tp -73.25 -26.14 60.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.181 0.515 . . . . 10.0 110.165 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.7 -27.36 69.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.715 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.85 -23.87 52.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.897 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 53.1 tp -72.53 -12.63 61.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.516 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 48.3 ttp -62.53 -29.13 70.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.983 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.54 78.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.687 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.81 -51.36 0.68 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.934 0.716 . . . . 10.0 112.934 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -83.76 34.32 0.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.221 0.534 . . . . 10.0 110.773 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 4.1 t80 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 179.975 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 112.102 -0.399 . . . . 10.0 112.102 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -61.37 2.23 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.52 0.563 . . . . 10.0 112.52 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.5 tp -63.6 -30.65 71.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.348 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -56.7 -26.29 56.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.926 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -106.79 -38.64 6.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.443 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.6 -39.87 85.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.942 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.06 -38.44 72.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.328 . . . . 10.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.38 -34.25 76.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.102 0.477 . . . . 10.0 110.785 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.9 0.74 46.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.924 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.47 -48.06 3.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.162 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -140.08 110.02 6.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.89 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.8 mt -76.17 114.89 16.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.702 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -126.6 92.03 45.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.873 0.368 . . . . 10.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -83.26 48.52 2.71 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.952 2.434 . . . . 10.0 111.979 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -93.15 -170.03 2.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.03 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -96.55 168.4 10.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.02 0.438 . . . . 10.0 111.612 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.0 mm -111.97 151.04 14.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.173 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.28 138.88 0.58 Allowed Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 179.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.4 137.74 1.46 Allowed 'Trans proline' 0 C--O 1.239 0.566 0 C-N-CA 123.354 2.702 . . . . 10.0 113.058 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.57 136.0 64.4 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.044 2.496 . . . . 10.0 112.059 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.18 123.65 88.05 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.643 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.0 -7.65 20.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.001 2.467 . . . . 10.0 112.466 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -36.6 78.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 10.0 111.034 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -132.88 -113.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.724 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -162.16 56.14 0.24 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.211 0.529 . . . . 10.0 110.912 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.7 tttm -151.57 155.19 37.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pp -84.55 151.69 24.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.705 -0.479 . . . . 10.0 109.705 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.97 175.92 7.9 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.633 -0.258 . . . . 10.0 110.386 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.47 119.53 29.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.652 0.263 . . . . 10.0 110.845 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.93 -70.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.269 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.408 ' C ' ' HE ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 175.37 -56.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.454 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.421 ' H1 ' ' CD ' ' B' ' 20' ' ' GLU . 9.0 tmm? . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.831 0.348 . . . . 10.0 110.708 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.25 141.91 30.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.826 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 76.4 t -128.8 126.78 65.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.128 0.489 . . . . 10.0 110.826 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -116.39 118.04 31.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.888 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.37 160.75 34.14 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.692 0.282 . . . . 10.0 111.13 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 58.1 mtm -127.83 108.63 10.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.863 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.9 mm -82.26 102.71 8.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -100.51 105.18 16.6 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.534 0.568 . . . . 10.0 112.534 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -94.14 82.67 4.17 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.959 -1.497 . . . . 10.0 106.959 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 66.79 -86.15 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.204 -177.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -119.65 6.88 11.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.151 0.5 . . . . 10.0 111.102 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.7 m -105.86 95.19 5.62 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 6.4 m -95.09 117.13 29.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.016 0.436 . . . . 10.0 110.943 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 52.8 mt -108.17 117.23 53.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.555 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -74.04 116.68 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.3 m -107.7 114.22 28.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.234 0.54 . . . . 10.0 111.511 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -103.49 110.6 22.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -141.14 -159.78 1.0 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.979 0.419 . . . . 10.0 111.937 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -129.86 161.27 31.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.344 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . 0.421 ' CD ' ' H1 ' ' B' ' 1' ' ' MET . 14.1 mt-10 -61.56 -24.49 66.68 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.663 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -16.61 59.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.303 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 19.2 m -76.04 144.03 41.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.501 0.191 . . . . 10.0 111.015 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 37.9 p -90.15 168.17 12.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.829 0.347 . . . . 10.0 111.042 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 79.4 t -67.42 -35.59 73.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.852 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -63.57 -32.81 74.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.1 0.476 . . . . 10.0 110.515 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.71 -34.08 77.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.417 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 69.9 mt -63.38 -44.65 94.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.447 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 94.3 mttt -62.1 -35.06 77.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.529 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -66.76 -34.38 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.222 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 85.8 mt -71.18 -45.55 70.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.55 -36.26 72.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.085 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -59.89 -39.82 86.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.66 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.64 -10.17 84.77 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.67 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.5 mt -103.04 -51.75 8.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 111.755 0.28 . . . . 10.0 111.755 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 58.5 mt -89.15 -13.06 39.28 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 57.83 43.5 21.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.399 0.618 . . . . 10.0 112.021 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -127.22 140.68 38.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.259 -0.882 . . . . 10.0 110.033 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -48.99 119.98 4.97 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.403 2.735 . . . . 10.0 112.986 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.72 -16.87 42.43 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.113 2.542 . . . . 10.0 112.258 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.71 -32.78 74.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.567 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -100.74 11.29 39.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.823 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -90.58 126.99 36.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -110.98 123.31 49.93 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.3 121.49 45.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.622 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -119.97 129.84 54.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.814 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 43.2 tttm -130.0 129.45 43.75 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 64.93 25.98 12.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.011 0.434 . . . . 10.0 110.287 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 71.98 19.06 4.8 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.27 -0.877 . . . . 10.0 111.235 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -125.94 152.96 44.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.281 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -78.1 137.35 38.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.378 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 92.8 mt -85.98 165.22 16.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.191 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -112.07 121.18 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.684 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.447 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 44.7 m-20 -61.83 -28.99 69.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.203 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.98 -5.17 86.39 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.552 -0.832 . . . . 10.0 113.431 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -104.66 157.51 17.13 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.112 0.456 . . . . 10.0 111.433 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.0 p -89.25 165.14 14.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.613 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 45.8 mt -59.04 -42.48 90.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.313 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.35 -31.62 66.6 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.046 -0.597 . . . . 10.0 112.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -79.73 -23.73 42.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.028 0.442 . . . . 10.0 110.914 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 52.0 m -86.66 0.8 53.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.6 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.77 8.88 57.92 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.977 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -80.6 98.51 7.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.888 0.375 . . . . 10.0 110.125 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.89 164.41 23.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.7 m -67.86 -10.94 57.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 10.0 112.048 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -77.93 -37.58 47.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.126 0.489 . . . . 10.0 110.066 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -48.08 6.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.852 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -94.26 96.47 9.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.784 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -107.34 161.14 24.02 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.547 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.41 -15.86 51.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.478 2.119 . . . . 10.0 111.481 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.75 2.14 23.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.987 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -163.84 85.91 1.25 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.576 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.29 147.6 42.27 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.739 2.293 . . . . 10.0 111.334 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.97 116.23 11.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.02 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.74 117.13 11.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.443 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.01 133.68 62.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.67 128.7 9.24 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.657 -0.782 . . . . 10.0 112.409 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.11 114.35 26.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 10.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.95 124.61 53.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.657 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -100.5 113.58 26.48 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -77.32 112.74 14.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.963 0.411 . . . . 10.0 111.54 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.54 147.83 52.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.524 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -71.46 139.62 49.71 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.07 -0.344 . . . . 10.0 110.07 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 t70 77.92 -31.0 0.16 Allowed 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.603 0.564 . . . . 10.0 112.224 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.9 m -83.3 95.11 8.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 10.0 111.059 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -74.23 -4.01 33.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.202 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -56.26 -32.44 64.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.663 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.07 76.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.209 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.2 mt -72.68 -18.76 61.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.978 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.15 -11.46 38.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.405 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 53.4 mt -101.44 -31.59 3.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.431 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.03 114.15 15.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.484 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -74.0 -0.65 9.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.1 2.533 . . . . 10.0 111.354 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.66 -16.09 37.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.987 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.24 -42.88 2.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.859 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 10.5 m -113.23 150.49 43.1 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.83 154.95 66.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.593 2.195 . . . . 10.0 111.553 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.73 130.6 37.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.882 2.388 . . . . 10.0 112.496 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.97 102.22 1.95 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.909 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.7 tp -140.27 130.0 13.55 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.833 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.41 131.77 47.75 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.992 2.461 . . . . 10.0 111.803 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -65.6 -34.42 78.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -68.97 -20.36 24.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.286 0.565 . . . . 10.0 110.532 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 65.4 mmm -107.6 54.97 0.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.65 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.465 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 32.9 mtpt -133.62 -47.71 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.97 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . 0.465 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 64.6 Cg_endo -72.95 45.23 0.88 Allowed 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.166 1.911 . . . . 10.0 113.493 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 -119.38 175.0 6.03 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.649 -0.501 . . . . 10.0 109.649 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -90.49 165.86 13.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.637 0.256 . . . . 10.0 110.379 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 50.7 m -89.99 143.85 26.42 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.211 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.96 -150.75 11.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.259 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.26 -27.93 15.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.36 0.6 . . . . 10.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.68 165.72 12.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.273 -0.876 . . . . 10.0 110.871 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.79 138.18 46.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.612 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 68.52 4.79 4.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.823 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -86.07 128.93 34.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -114.67 141.68 47.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.941 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.21 101.17 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -74.04 133.97 30.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.787 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.994 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.893 0.378 . . . . 10.0 110.923 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -108.84 113.8 27.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.961 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 mt -91.29 127.83 36.88 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -113.14 120.61 63.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.489 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -94.31 166.52 12.04 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.126 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -1.24 11.83 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.198 0.444 . . . . 10.0 112.198 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -95.06 2.96 55.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.851 0.357 . . . . 10.0 110.216 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.06 33.54 57.0 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.78 -0.724 . . . . 10.0 111.433 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -108.65 128.4 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -97.02 121.67 39.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.896 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -112.35 110.03 20.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.601 0.239 . . . . 10.0 110.585 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 21.6 mm -96.06 116.03 36.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.9 t -104.72 135.9 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.406 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -58.97 131.89 52.39 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -57.89 -34.86 70.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 10.0 112.013 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -56.78 -38.11 72.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.693 0.282 . . . . 10.0 111.411 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -82.96 -32.67 26.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.141 0.496 . . . . 10.0 110.083 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.82 -29.72 70.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.89 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.29 -55.9 28.96 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.417 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.8 -40.1 96.32 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.283 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.0 m -62.2 -35.34 78.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.469 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.44 -18.18 79.95 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.092 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 14.0 m -79.76 -28.57 40.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.089 0.471 . . . . 10.0 109.765 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mt -74.53 149.76 7.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.158 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.61 113.47 6.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 10.0 110.414 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -134.06 177.57 7.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.871 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.4 mmm -78.87 38.06 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.894 0.378 . . . . 10.0 111.581 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.64 -37.73 85.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.23 0.538 . . . . 10.0 110.019 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.5 m -91.56 18.58 7.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.314 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.53 -60.55 5.74 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.671 -0.695 . . . . 10.0 112.834 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.84 172.02 7.71 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.356 2.038 . . . . 10.0 112.311 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.23 -55.18 27.74 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 115.885 -0.598 . . . . 10.0 113.167 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -149.67 110.48 4.3 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.505 -0.409 . . . . 10.0 111.11 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -77.27 90.6 3.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.087 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.4 171.83 14.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.137 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.07 -33.59 69.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.329 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -60.85 -44.13 97.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.156 0.503 . . . . 10.0 109.85 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -72.6 -26.21 61.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.685 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 10.4 m -74.07 -35.41 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.248 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -76.48 -50.92 12.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.109 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -124.8 107.32 10.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.302 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 t -92.89 103.66 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.972 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -90.14 119.48 30.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.977 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -98.81 142.29 30.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.214 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -112.58 135.72 52.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.405 -0.362 . . . . 10.0 111.609 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 64.92 19.48 11.86 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.47 -0.786 . . . . 10.0 112.197 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.0 mt -114.74 107.46 50.57 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.396 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -59.71 149.52 82.39 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 123.191 2.594 . . . . 10.0 112.377 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -65.01 -35.86 82.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.758 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -56.16 24.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.953 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -67.62 -33.3 61.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.354 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.63 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -59.66 -38.04 80.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -67.11 -32.6 73.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.355 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.84 -46.76 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -59.84 -41.45 91.39 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.702 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 59.7 mtm -68.51 -39.32 81.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.787 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -63.07 -44.84 94.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.718 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.27 -44.99 95.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.397 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 57.8 m -58.73 -41.98 87.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.865 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.43 -47.41 76.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.914 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -59.04 -40.93 86.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.866 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 42.2 t -57.96 -50.23 78.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.625 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -72.07 -38.82 69.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.949 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -58.03 -42.37 85.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.47 19.94 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.005 0.431 . . . . 10.0 111.513 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -128.4 -44.66 1.38 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.803 0.335 . . . . 10.0 111.543 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.98 -38.67 0.27 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.956 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.68 41.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.868 0.322 . . . . 10.0 111.868 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.66 -18.96 33.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.329 0.585 . . . . 10.0 110.247 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -73.0 -14.62 61.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.952 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 17.1 pt -101.03 160.45 26.64 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -73.93 175.27 11.05 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.318 2.012 . . . . 10.0 113.015 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.41 172.52 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.485 -0.78 . . . . 10.0 109.508 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -49.66 126.36 17.82 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 122.457 0.303 . . . . 10.0 110.528 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.28 122.77 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.295 2.664 . . . . 10.0 113.029 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 5.7 pt -76.58 59.77 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.752 -0.658 . . . . 10.0 112.341 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.96 -59.12 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.56 106.84 2.04 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.159 1.906 . . . . 10.0 111.682 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -73.46 50.69 0.32 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.049 -0.523 . . . . 10.0 112.372 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -110.17 19.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.71 0.767 . . . . 10.0 109.862 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.5 -42.43 18.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.062 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.35 -30.17 70.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.208 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -59.7 -41.67 91.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.998 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 87.3 mt -78.77 -38.04 39.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.705 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -61.44 -32.37 72.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.357 -0.838 . . . . 10.0 110.846 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 33.0 ttp -59.6 -19.85 51.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.989 -0.55 . . . . 10.0 112.083 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.46 -32.49 71.44 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.54 -58.89 0.42 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 124.021 0.826 . . . . 10.0 113.223 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -82.04 39.45 0.57 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.164 0.507 . . . . 10.0 111.025 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.492 -0.243 . . . . 10.0 112.492 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -66.18 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 -179.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.98 -27.26 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.499 -178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -55.34 -29.7 58.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.601 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -102.25 -40.43 6.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.96 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.4 mt -57.66 -36.11 71.44 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.498 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.48 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.72 0.295 . . . . 10.0 110.586 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.48 -31.22 70.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.383 0.611 . . . . 10.0 110.127 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.46 -18.18 61.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.819 . . . . 10.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.57 -53.21 4.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.24 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.89 132.62 21.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 111.593 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.2 mt -88.97 114.46 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -116.38 100.47 53.48 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.401 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -89.41 32.9 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.121 2.548 . . . . 10.0 111.826 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -92.23 170.4 9.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.004 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -83.23 160.51 21.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.906 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.6 mm -108.98 153.78 10.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.441 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -167.18 133.76 1.85 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -39.21 127.64 1.44 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.612 2.874 . . . . 10.0 113.031 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.89 127.5 24.59 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 123.349 2.699 . . . . 10.0 112.297 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.14 132.12 91.94 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.519 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.94 -20.58 45.38 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 123.445 2.763 . . . . 10.0 113.745 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -34.13 77.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.782 0.325 . . . . 10.0 111.244 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.1 m -128.37 -160.8 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.696 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -129.99 51.52 2.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 10.0 110.815 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -149.7 148.0 28.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.602 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.01 154.27 41.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.909 0.385 . . . . 10.0 111.148 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.03 162.42 14.38 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.756 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.2 tt0 -112.02 115.45 28.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.254 -0.276 . . . . 10.0 110.254 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -156.87 -76.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.865 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.18 -59.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.3 m0 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.359 -0.829 . . . . 10.0 109.857 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmm . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.59 0.233 . . . . 10.0 111.506 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.63 142.14 28.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 95.6 t -127.8 125.66 65.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.775 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -113.77 112.35 23.28 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.615 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.57 158.04 41.08 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.785 0.326 . . . . 10.0 111.06 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 31.7 mtm -126.24 112.81 16.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.734 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mm -84.32 105.69 13.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -100.85 102.35 13.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 32.3 ttp85 -92.38 65.33 4.51 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.036 -1.468 . . . . 10.0 107.036 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 65.11 -86.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.022 -0.99 . . . . 10.0 111.479 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -95.24 -21.65 18.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.665 0.246 . . . . 10.0 111.665 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -99.58 105.18 17.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.665 0.269 . . . . 10.0 111.684 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 26.4 m -103.18 121.39 42.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.716 0.293 . . . . 10.0 110.236 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 64.3 mt -111.08 117.95 56.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.434 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -77.39 113.09 14.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -106.26 108.27 19.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.325 0.583 . . . . 10.0 111.928 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -95.46 106.45 18.52 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.684 -1.228 . . . . 10.0 107.684 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -129.28 -165.85 1.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.548 -0.296 . . . . 10.0 111.286 -178.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -125.32 160.65 28.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.28 -21.87 66.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.91 0.386 . . . . 10.0 111.953 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -16.98 57.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.389 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.6 m -72.99 147.0 45.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.887 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 38.9 p -96.79 166.13 11.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.922 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.58 -35.17 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.184 0.516 . . . . 10.0 109.705 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -60.58 -37.55 81.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.994 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -65.07 -34.63 78.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.958 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.93 -45.37 92.83 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.806 -0.442 . . . . 10.0 109.806 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.442 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 96.0 mttt -64.28 -34.03 77.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.539 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -67.26 -33.29 75.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.148 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -72.14 -46.29 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 88.0 t -64.2 -31.64 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.234 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.36 -43.11 78.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.973 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.26 -19.71 79.45 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 10.0 112.515 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 75.2 mt -87.69 -59.75 2.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 111.845 0.313 . . . . 10.0 111.845 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.6 mt -80.83 -12.67 59.39 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.086 0.402 . . . . 10.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 84.9 mttt 60.17 36.35 21.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.155 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 27.3 mtt180 -127.65 144.82 52.5 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.731 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.52 127.68 16.49 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.699 2.933 . . . . 10.0 113.856 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.39 -19.76 28.44 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.886 2.391 . . . . 10.0 111.81 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.66 -28.85 68.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.691 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -94.28 0.23 55.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.32 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -84.93 129.03 34.87 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.241 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 64.9 mmt-85 -116.7 107.11 14.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.189 -0.459 . . . . 10.0 109.862 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.4 mt -89.63 113.73 25.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.554 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -110.8 113.59 26.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.125 0.488 . . . . 10.0 111.813 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -119.01 128.91 54.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 62.93 37.78 11.71 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.488 0.493 . . . . 10.0 110.947 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 64.36 21.43 12.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.218 -0.901 . . . . 10.0 112.027 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -136.73 155.65 49.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.8 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.7 tp -78.13 141.13 38.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.466 -0.333 . . . . 10.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 mt -84.89 151.82 24.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.076 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -88.72 118.57 28.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.281 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.442 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 5.0 m-20 -62.15 -26.99 68.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 10.0 112.267 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.37 2.69 81.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.074 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -109.81 154.97 22.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.231 0.539 . . . . 10.0 111.731 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 36.5 p -86.79 172.21 10.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.501 -0.772 . . . . 10.0 109.59 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 54.2 mt -63.71 -37.63 88.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.701 0.286 . . . . 10.0 110.399 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.83 -33.74 87.83 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.893 -0.67 . . . . 10.0 112.182 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.57 -25.82 45.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.697 0.284 . . . . 10.0 111.525 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.9 m -89.41 0.96 56.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.18 64.31 1.66 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.714 -0.755 . . . . 10.0 113.096 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -124.7 47.37 2.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.857 0.36 . . . . 10.0 110.175 179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 79.1 p -68.34 164.02 21.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -17.39 63.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.765 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.84 -30.17 50.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.09 0.471 . . . . 10.0 110.239 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.94 -36.27 12.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.075 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -108.45 100.22 9.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 109.875 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.04 157.0 44.55 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.21 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.87 -14.79 46.26 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.372 2.048 . . . . 10.0 111.33 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.78 0.86 24.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.622 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.438 ' CB ' ' H ' ' B' ' 112' ' ' ALA . . . -164.51 90.29 1.04 Allowed Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.126 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -76.76 138.07 18.55 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.956 2.437 . . . . 10.0 111.449 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.96 122.88 16.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.666 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.03 122.6 25.16 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.569 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 45.3 t -125.6 129.24 72.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.37 140.85 19.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.785 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -119.86 105.46 11.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.049 0.452 . . . . 10.0 111.885 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.8 127.96 44.88 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -104.04 117.73 34.98 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.954 -0.298 . . . . 10.0 111.187 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -71.98 97.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.684 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.67 126.53 47.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.188 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.26 134.47 57.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.876 -0.602 . . . . 10.0 112.084 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 67.8 7.58 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.432 -0.804 . . . . 10.0 112.542 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 4.2 m -105.56 98.71 8.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.165 0.507 . . . . 10.0 110.325 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -66.92 -14.23 62.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.098 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -57.12 -32.17 66.07 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.998 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.48 67.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.79 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.7 mt -83.12 -5.25 59.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.521 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 27.2 m -105.28 -14.84 15.22 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.3 mt -104.23 6.29 10.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.155 0.502 . . . . 10.0 111.164 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -104.52 107.24 57.36 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.173 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.58 -10.66 27.22 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.049 2.5 . . . . 10.0 111.955 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -76.81 -20.68 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.912 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -119.14 -48.42 2.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.954 -0.567 . . . . 10.0 111.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 20.0 m -115.13 141.47 27.07 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.965 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.44 153.74 75.8 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.526 2.151 . . . . 10.0 111.929 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.19 141.46 94.44 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.046 2.497 . . . . 10.0 112.633 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -72.71 117.61 14.63 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.187 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 31.6 tp -146.32 124.23 6.18 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.486 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -66.64 136.27 41.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.751 2.301 . . . . 10.0 112.13 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -66.83 -30.91 71.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.397 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.7 m -70.91 -16.04 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.496 0.665 . . . . 10.0 110.243 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 88.1 mmm -124.27 54.49 1.35 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.318 -0.856 . . . . 10.0 108.99 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.437 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 39.9 tttm -132.23 -49.5 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.329 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . 0.437 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 10.3 Cg_exo -73.02 65.57 4.15 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 122.309 2.006 . . . . 10.0 111.958 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -134.72 174.97 9.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.902 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -90.87 176.96 6.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.845 0.355 . . . . 10.0 111.201 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -102.93 135.62 44.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.123 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -88.82 -143.64 9.58 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.046 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.84 -38.47 11.22 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.185 0.516 . . . . 10.0 110.722 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.3 m -76.75 159.61 30.0 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.761 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . 0.438 ' H ' ' CB ' ' B' ' 71' ' ' ALA . . . -67.16 121.14 14.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 179.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 72.33 16.92 4.97 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.915 0.759 . . . . 10.0 111.903 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -71.53 119.98 16.45 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.822 0.344 . . . . 10.0 110.078 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.88 122.48 33.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.834 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.9 103.28 12.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.883 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 t -90.46 101.38 12.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.52 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -179.254 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.78 0.324 . . . . 10.0 111.363 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -110.87 117.59 33.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.707 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 31.7 mt -92.61 123.56 36.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.081 -0.509 . . . . 10.0 109.839 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 mt -107.57 116.98 52.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.8 p -89.04 177.76 6.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.494 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 13.7 m -76.99 2.85 13.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.862 0.363 . . . . 10.0 111.658 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -102.14 3.67 38.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 10.0 110.356 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.56 12.83 84.13 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.649 -0.786 . . . . 10.0 111.398 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.6 133.94 33.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.657 0.265 . . . . 10.0 110.324 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -107.18 126.66 52.68 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.071 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.66 108.57 16.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.562 -0.29 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -89.79 118.68 35.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.841 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 23.6 t -105.95 135.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 53.7 tttt -59.71 132.04 52.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 110.135 -0.321 . . . . 10.0 110.135 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -52.06 -37.04 52.39 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.447 0.467 . . . . 10.0 111.21 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -54.53 -43.22 71.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.537 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -85.27 -33.36 22.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.035 0.445 . . . . 10.0 110.742 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.47 91.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.521 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 89.2 mt -58.39 -48.18 81.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.966 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -39.54 93.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.468 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -64.88 -36.7 85.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.8 -6.7 82.48 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.657 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 19.8 m -91.02 -22.1 20.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.307 0.575 . . . . 10.0 109.71 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -76.6 152.44 5.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.651 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -70.62 80.53 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.175 0.512 . . . . 10.0 110.529 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -97.36 178.15 5.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.853 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 94.3 mmm -78.5 35.39 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.981 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.57 -26.54 66.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.353 0.597 . . . . 10.0 109.606 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 4.3 m -95.54 17.65 14.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.243 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.85 -61.99 3.8 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.573 -0.739 . . . . 10.0 112.673 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.33 -174.8 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.514 2.143 . . . . 10.0 111.901 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.04 -79.21 0.15 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.986 -0.626 . . . . 10.0 112.519 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -122.24 127.71 50.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -88.65 85.17 6.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.317 0.579 . . . . 10.0 111.076 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.11 155.39 32.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.34 -25.43 49.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.996 0.739 . . . . 10.0 112.996 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.11 -39.45 90.02 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.616 -0.512 . . . . 10.0 109.616 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -88.84 -13.98 38.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.267 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 6.8 m -78.27 -40.26 37.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 10.0 110.191 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -75.66 -44.43 42.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.179 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -128.63 103.62 7.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.321 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.9 t -94.8 123.64 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.885 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -101.35 121.03 41.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.877 0.37 . . . . 10.0 110.892 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -101.61 117.31 34.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.956 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 -92.16 132.79 36.35 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.374 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 75.11 3.81 4.15 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.998 0.811 . . . . 10.0 112.279 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 72.1 mt -106.62 109.02 62.85 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.984 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.57 157.68 59.5 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.152 2.568 . . . . 10.0 112.127 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.9 p -64.78 -39.36 93.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.498 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -52.24 -59.07 4.83 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.818 0.673 . . . . 10.0 112.818 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.93 -35.66 75.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 10.0 111.397 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 -33.97 77.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.804 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 26.1 m -61.92 -43.06 99.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.893 0.378 . . . . 10.0 110.547 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -66.43 -35.6 80.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.311 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 88.1 t -63.36 -47.55 91.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.09 179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 36.0 m -60.29 -42.92 96.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.854 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.3 mtm -67.26 -37.27 83.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -65.74 -41.95 91.56 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.427 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -64.72 -45.7 85.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.104 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 42.9 m -58.69 -42.35 88.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.301 0.572 . . . . 10.0 109.665 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -64.75 -43.7 92.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.143 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -62.79 -40.75 98.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.098 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.07 -50.48 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -68.89 -37.85 79.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.338 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -58.2 -48.24 80.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.064 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.13 7.05 23.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.67 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.85 -46.93 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.177 -0.327 . . . . 10.0 111.57 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 6.3 m -146.15 -34.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 4.9 m -80.74 42.5 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.296 0.48 . . . . 10.0 112.296 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.06 -7.13 57.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.241 0.543 . . . . 10.0 110.066 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -78.76 -21.54 47.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 39.7 pt -95.96 163.8 20.17 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.194 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -76.99 -177.31 3.72 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.304 2.003 . . . . 10.0 112.726 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.96 169.9 13.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.009 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -54.16 128.98 58.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.556 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -50.76 129.49 27.5 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.126 2.551 . . . . 10.0 112.834 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 pt -81.65 36.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.08 -59.71 0.53 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.395 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -79.74 119.67 4.09 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.764 1.643 . . . . 10.0 110.505 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.35 12.32 1.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 38.4 mm -78.9 75.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.408 0.623 . . . . 10.0 109.952 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -138.92 -43.21 0.47 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.119 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 13.4 tp -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.644 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 23.9 mp0 -60.5 -37.29 80.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.325 -0.852 . . . . 10.0 109.47 178.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 60.3 mt -79.49 -36.64 38.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.731 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.77 -31.75 73.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.525 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.9 ttp -58.98 -25.2 63.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.915 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.15 -35.49 73.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.05 -55.2 0.56 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.293 0.849 . . . . 10.0 113.293 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -81.97 36.17 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.117 0.484 . . . . 10.0 111.14 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.695 -0.669 . . . . 10.0 109.574 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.195 -0.362 . . . . 10.0 112.195 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -57.82 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.5 tp -63.12 -27.85 69.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.933 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -55.51 -35.09 65.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.265 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -95.36 -37.33 11.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.329 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.07 -36.85 84.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.385 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.8 88.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.349 . . . . 10.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.3 tp -68.6 -30.03 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.279 0.561 . . . . 10.0 109.547 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.43 -8.89 59.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.52 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.15 -35.69 11.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.171 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 tp -163.56 122.38 2.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.172 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.0 mt -82.55 92.65 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -104.45 107.21 57.16 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.44 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -95.29 52.62 0.2 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.325 2.684 . . . . 10.0 111.173 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -108.87 174.82 5.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.874 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -80.47 143.02 33.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.739 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -100.24 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.074 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.88 136.24 25.38 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -34.5 133.49 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.147 3.231 . . . . 10.0 113.624 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -62.98 138.23 66.78 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.0 2.467 . . . . 10.0 112.442 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.48 125.76 91.76 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.376 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -61.13 -22.33 74.35 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.224 2.616 . . . . 10.0 113.198 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -35.89 82.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.051 0.453 . . . . 10.0 111.074 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 t -120.07 -132.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.86 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -158.98 52.66 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.112 0.482 . . . . 10.0 111.258 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -149.57 148.44 29.36 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -72.65 148.9 44.35 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.83 0.347 . . . . 10.0 110.681 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.4 172.93 8.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.075 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -117.16 113.59 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.399 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -156.57 -81.64 0.07 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 -62.62 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.9 m0 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.54 179.654 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 mmm . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.949 0.404 . . . . 10.0 110.801 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.77 122.95 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.922 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.3 t -123.65 116.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.107 0.48 . . . . 10.0 111.095 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -105.08 110.97 23.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.551 -0.75 . . . . 10.0 109.473 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.56 154.63 40.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.991 0.425 . . . . 10.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 53.9 mtm -122.77 104.87 9.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.334 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.4 mm -78.2 107.25 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.912 -0.773 . . . . 10.0 108.912 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -109.95 104.4 13.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.866 0.691 . . . . 10.0 112.866 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 27.8 ttp85 -89.03 67.43 8.1 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.595 -1.261 . . . . 10.0 107.595 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 67.77 -76.69 0.05 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.174 -0.921 . . . . 10.0 111.485 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -110.01 -9.35 14.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.483 -0.326 . . . . 10.0 111.382 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -105.2 99.59 9.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.062 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.2 m -101.17 125.53 47.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.923 0.392 . . . . 10.0 111.019 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 40.2 mt -121.52 121.85 65.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.313 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -79.6 121.69 25.58 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 2.0 m -114.7 119.82 38.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.089 0.471 . . . . 10.0 111.452 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -103.31 103.68 13.72 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.207 -1.034 . . . . 10.0 108.207 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.64 -166.66 1.72 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.653 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -128.88 165.5 20.92 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.754 -0.462 . . . . 10.0 109.754 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -61.52 -28.46 69.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.649 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 m -69.13 -21.49 64.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.85 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 2.3 m -73.75 145.23 45.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.743 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 31.5 p -94.34 162.97 13.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.761 0.315 . . . . 10.0 111.033 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.89 -34.03 67.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.133 0.492 . . . . 10.0 109.992 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -62.56 -34.99 78.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.406 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -68.24 -33.37 74.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.906 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.1 mt -62.15 -43.71 98.24 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.459 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 99.1 mttt -62.23 -33.81 75.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.237 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtp180 -66.2 -40.44 90.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.512 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.61 -46.8 91.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.835 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.98 -36.84 77.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.673 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -56.5 -43.39 79.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.34 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.88 -18.02 78.74 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -94.08 -57.29 4.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.774 0.321 . . . . 10.0 111.528 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 22.1 mt -76.87 -14.19 59.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.3 mttt 64.75 31.61 11.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.373 0.606 . . . . 10.0 110.994 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -123.42 135.08 25.67 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.856 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -53.07 138.82 62.61 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 123.384 2.723 . . . . 10.0 113.028 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.82 -12.53 31.03 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.831 2.354 . . . . 10.0 111.19 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.15 -45.66 75.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.204 -0.907 . . . . 10.0 112.134 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -99.83 16.76 22.68 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -88.04 123.45 32.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.816 0.341 . . . . 10.0 110.849 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -116.1 111.86 20.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.11 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -96.01 120.39 36.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.402 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -113.75 127.8 56.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.0 tttm -135.49 137.26 41.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 62.44 25.26 15.06 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.347 0.405 . . . . 10.0 110.379 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 75.18 4.32 4.16 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.404 -0.816 . . . . 10.0 112.239 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -119.54 163.11 17.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.069 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.0 tp -79.97 141.14 36.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.544 0.211 . . . . 10.0 110.689 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -80.37 155.58 27.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.318 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -98.92 115.37 28.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.859 0.361 . . . . 10.0 111.199 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.459 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 78.4 m-20 -60.33 -29.37 68.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.639 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 3.84 75.88 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.003 -0.617 . . . . 10.0 113.485 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -118.02 163.53 16.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.066 0.46 . . . . 10.0 111.017 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 41.5 p -92.25 170.44 9.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.896 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.26 -41.91 98.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.904 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.73 -40.58 95.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.09 -0.576 . . . . 10.0 112.512 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -72.27 -21.16 61.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 10.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 70.2 m -89.47 3.17 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.009 0.433 . . . . 10.0 111.646 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.61 2.72 63.1 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.724 -0.751 . . . . 10.0 113.293 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -75.77 96.85 3.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.05 0.425 . . . . 10.0 110.171 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 55.1 p -114.94 164.55 13.98 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 20.0 m -72.52 -2.45 19.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.304 0.573 . . . . 10.0 110.476 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -90.17 -49.42 6.57 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.642 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -35.02 55.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.043 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.11 103.69 12.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -119.31 163.07 28.81 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.731 -178.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -66.78 -14.88 45.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.043 1.829 . . . . 10.0 110.531 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.76 -1.62 27.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.169 -0.923 . . . . 10.0 110.104 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -163.63 84.17 1.35 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.438 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.87 136.41 16.68 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.855 2.37 . . . . 10.0 111.837 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 122.19 17.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.418 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -80.81 124.69 29.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.948 0.404 . . . . 10.0 111.448 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.6 t -117.87 125.92 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.95 126.85 7.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.768 -0.73 . . . . 10.0 111.91 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.54 111.17 22.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.719 0.295 . . . . 10.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -107.29 128.91 54.87 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.669 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -105.04 116.58 32.19 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.229 -0.285 . . . . 10.0 110.229 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -76.75 85.5 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.581 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -96.72 131.42 43.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.77 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.79 140.22 58.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.28 7.4 4.87 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.982 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.8 m -117.87 104.59 11.08 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -76.68 0.36 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 10.0 112.061 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -57.12 -32.22 66.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.04 0.448 . . . . 10.0 110.657 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.23 -26.24 67.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.747 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.8 mt -75.66 -26.29 57.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.831 0.348 . . . . 10.0 111.005 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 22.4 m -83.61 -32.32 25.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 17.6 mt -81.78 -27.09 9.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.388 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -70.01 110.51 6.8 Favored Pre-proline 0 C--O 1.234 0.284 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.314 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.88 -8.89 24.74 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.544 2.829 . . . . 10.0 112.531 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.842 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.9 m -99.0 -44.68 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.236 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 13.0 m -107.48 144.35 29.05 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 159.84 47.42 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.595 2.197 . . . . 10.0 111.576 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.22 128.07 21.79 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.559 2.172 . . . . 10.0 111.473 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.76 106.84 3.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.101 0.476 . . . . 10.0 111.668 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 35.1 tp -129.78 120.71 19.65 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.188 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -51.43 120.31 6.73 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.755 2.303 . . . . 10.0 111.761 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.01 -33.7 71.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.427 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.14 -15.32 18.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.808 0.337 . . . . 10.0 111.347 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 67.5 mmm -115.22 21.28 14.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.412 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -96.41 -51.08 0.23 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 113.565 0.95 . . . . 10.0 113.565 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.62 82.87 1.12 Allowed 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.145 1.897 . . . . 10.0 112.743 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -161.03 -171.69 3.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.689 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -104.83 174.99 5.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.916 0.389 . . . . 10.0 111.215 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -100.99 157.12 16.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.49 -129.99 5.1 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.678 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 10.5 m -110.93 -31.09 7.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.093 0.473 . . . . 10.0 110.024 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 51.0 m -86.53 170.76 11.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.932 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.47 134.04 36.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.1 t30 70.59 7.38 6.19 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.555 0.535 . . . . 10.0 111.032 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -84.9 121.06 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -108.87 151.78 25.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.741 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -128.81 103.81 7.27 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.477 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.7 134.29 30.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 12.6 mp0 . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.183 179.764 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.061 0.457 . . . . 10.0 110.841 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -105.25 115.86 30.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.452 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 25.2 mt -90.63 133.29 35.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.882 -0.784 . . . . 10.0 108.882 178.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 13.3 mt -118.6 113.63 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.762 -0.199 . . . . 10.0 110.691 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.15 161.33 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -20.98 64.78 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.256 0.465 . . . . 10.0 112.256 -179.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -74.15 -10.48 59.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.704 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.16 39.25 8.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.595 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -111.73 140.95 45.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.719 0.295 . . . . 10.0 110.265 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -99.86 128.64 45.94 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.495 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -127.69 96.73 4.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.95 0.405 . . . . 10.0 110.531 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.55 116.48 34.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.001 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.5 t -100.54 141.5 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.823 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -55.98 130.09 42.44 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.169 0.293 . . . . 10.0 110.237 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -54.6 -34.8 62.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.702 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -56.49 -46.85 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.154 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -74.65 -31.95 62.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.15 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.44 68.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.909 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 55.4 mt -58.75 -56.82 17.3 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.151 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -65.9 -31.39 72.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.716 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 43.9 m -65.32 -33.27 75.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 10.0 109.922 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.17 -12.82 82.8 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.128 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.09 -12.5 57.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.389 0.614 . . . . 10.0 110.029 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 45.5 mt -90.71 146.69 5.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.813 -0.81 . . . . 10.0 108.813 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.33 76.52 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.438 0.637 . . . . 10.0 111.102 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.55 -174.21 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.094 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 91.7 mmm -79.12 37.36 0.31 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mp -69.8 -32.64 71.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.16 13.96 19.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.17 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.97 -56.3 4.5 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.633 -0.712 . . . . 10.0 113.109 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -66.73 179.63 2.09 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.661 2.241 . . . . 10.0 112.434 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.28 -46.77 14.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.698 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -141.76 104.68 4.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.766 0.317 . . . . 10.0 110.606 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -87.02 89.61 8.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.98 0.419 . . . . 10.0 110.602 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.98 174.91 8.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.569 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.23 -25.85 68.25 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.673 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -58.98 -43.28 91.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.054 0.454 . . . . 10.0 109.779 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -75.34 -18.49 59.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.822 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.9 m -78.57 -30.32 46.75 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -81.68 -50.88 8.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.661 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.18 107.13 9.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -94.55 103.77 15.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.455 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -89.39 122.68 32.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.036 0.446 . . . . 10.0 111.053 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -103.62 144.03 31.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.632 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -113.65 132.52 55.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.507 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 61.02 28.94 18.68 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.694 0.621 . . . . 10.0 112.663 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 83.7 mt -121.82 103.08 40.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.587 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -57.5 140.28 92.77 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.092 2.528 . . . . 10.0 113.097 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -59.61 -36.1 75.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.278 -0.873 . . . . 10.0 111.093 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -51.22 70.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.43 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.1 m -70.85 -29.21 36.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.95 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 tp -66.37 -36.91 84.08 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -61.98 -33.94 75.24 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.139 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 13.4 tptp -65.42 -39.93 92.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.571 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -67.24 -46.52 83.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.933 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 76.5 m -58.21 -42.87 87.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.428 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.2 mtm -64.9 -39.52 93.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.815 0.34 . . . . 10.0 110.884 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -67.48 -39.06 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.379 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -64.22 -46.5 83.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.06 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 31.5 m -59.19 -42.1 90.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.374 0.607 . . . . 10.0 109.782 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -66.56 -43.48 84.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.39 179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -63.62 -38.77 92.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.492 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.35 -47.44 92.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.986 0.422 . . . . 10.0 110.253 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.867 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -58.21 -45.08 88.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.639 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -87.31 21.54 2.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.202 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -131.4 -47.82 0.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.085 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.22 -39.87 0.4 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.011 0.375 . . . . 10.0 112.011 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.53 39.67 0.21 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.04 -11.03 45.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.126 0.488 . . . . 10.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -92.57 4.82 52.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.42 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 pt -118.25 156.38 50.76 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.186 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.69 159.72 16.43 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.2 2.6 . . . . 10.0 112.999 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -69.09 171.08 8.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.215 -0.902 . . . . 10.0 109.597 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -47.91 130.76 11.76 Favored Pre-proline 0 C--O 1.233 0.19 0 O-C-N 123.291 0.369 . . . . 10.0 110.923 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -53.09 111.8 0.76 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.078 2.519 . . . . 10.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 15.1 pt -76.75 61.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.371 0.605 . . . . 10.0 111.18 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -114.67 -53.3 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.11 119.72 6.85 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.948 1.765 . . . . 10.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.78 -14.58 46.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.404 0.52 . . . . 10.0 112.404 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -79.62 98.67 3.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.046 0.451 . . . . 10.0 110.471 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.08 -43.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.648 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 15.9 tp -67.18 -24.28 65.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 32.9 mp0 -62.88 -29.65 70.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.985 -1.007 . . . . 10.0 109.779 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.01 -32.45 57.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.452 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -21.41 63.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.984 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.0 ttp -66.1 -18.74 65.54 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.663 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.95 -33.18 75.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.776 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.72 -61.28 0.37 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.985 0.803 . . . . 10.0 112.933 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -82.65 45.95 1.03 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.903 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.097 -0.705 . . . . 10.0 109.097 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 112.145 -0.382 . . . . 10.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -55.9 18.39 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.37 -30.47 69.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -58.12 -32.68 68.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 10.0 111.042 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -96.95 -40.8 8.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.001 0.429 . . . . 10.0 110.426 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.27 -42.7 95.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.16 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.23 64.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.727 0.298 . . . . 10.0 111.082 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.2 tp -63.83 -40.06 95.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.023 0.44 . . . . 10.0 110.422 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -14.15 59.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.955 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.9 -24.16 20.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -164.54 110.37 1.0 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 10.0 111.835 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.2 mt -84.31 88.02 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -96.1 106.65 29.83 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.836 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -88.23 60.32 3.02 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.546 2.831 . . . . 10.0 112.092 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -126.91 167.28 16.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -79.32 151.97 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.24 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.2 mm -113.47 100.02 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.456 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.6 tttp -107.63 138.26 19.94 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.41 133.12 0.16 Allowed 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.756 2.97 . . . . 10.0 113.422 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -53.42 151.85 22.26 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.898 3.065 . . . . 10.0 114.281 -178.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mp -81.07 122.36 81.59 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.641 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -59.19 -26.21 80.91 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.274 2.649 . . . . 10.0 113.091 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -35.96 78.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.62 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.3 m -118.59 -145.53 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -143.29 53.8 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.381 0.61 . . . . 10.0 110.634 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -150.38 150.28 31.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.026 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 pp -76.04 156.12 34.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 10.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.05 152.11 21.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.668 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -107.35 106.16 16.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.861 0.362 . . . . 10.0 110.509 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -164.36 -72.58 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.114 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.28 -69.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.143 -0.932 . . . . 10.0 109.4 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.855 0.359 . . . . 10.0 110.508 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.12 136.15 39.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.824 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.97 124.46 67.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.165 0.507 . . . . 10.0 110.93 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -113.74 111.7 22.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.735 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.32 156.15 40.88 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.962 0.411 . . . . 10.0 111.66 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 67.3 mtm -124.2 107.77 11.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.313 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.1 mm -80.56 109.45 15.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -105.74 105.89 16.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.162 0.431 . . . . 10.0 112.162 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 10.0 ttp85 -104.6 95.42 5.9 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 66.13 -88.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.622 0.577 . . . . 10.0 109.691 -178.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -129.16 11.4 5.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.321 0.581 . . . . 10.0 110.434 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -106.45 99.08 8.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.293 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 30.9 m -100.68 126.29 47.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.903 0.382 . . . . 10.0 111.083 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 64.7 mt -114.66 119.64 62.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.581 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -76.91 117.42 18.5 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.311 -0.625 . . . . 10.0 109.311 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.5 m -112.23 109.82 19.72 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.815 0.672 . . . . 10.0 112.815 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.05 106.87 19.29 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.322 -1.362 . . . . 10.0 107.322 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.31 -168.86 2.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.905 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -124.89 161.02 27.48 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.67 -27.1 66.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 10.0 111.74 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.56 -17.79 63.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.695 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.9 m -78.39 134.7 37.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.878 0.371 . . . . 10.0 110.781 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 20.1 p -85.13 167.26 15.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.197 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.39 -35.82 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 10.0 110.761 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -65.33 -33.34 75.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.638 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -65.74 -30.03 70.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.83 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 64.0 mt -66.8 -42.78 85.39 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -62.23 -31.57 72.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.212 -0.904 . . . . 10.0 110.526 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -64.59 -41.3 96.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.769 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.69 -43.4 93.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.96 -35.52 73.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.154 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.97 -41.11 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.02 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.93 -20.88 79.71 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.04 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.9 mt -93.77 -49.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 23.8 mt -84.58 -14.84 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.334 0.494 . . . . 10.0 112.334 -178.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 63.74 32.02 13.92 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.12 0.486 . . . . 10.0 111.696 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -126.35 146.27 55.72 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.866 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.71 133.01 55.28 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.418 2.745 . . . . 10.0 113.554 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -70.3 -17.35 35.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.539 2.826 . . . . 10.0 112.165 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -65.51 -31.57 72.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.572 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -90.94 -1.72 57.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -89.28 126.34 35.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.37 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -116.41 113.63 23.13 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 48.4 mt -92.31 114.76 27.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.859 0.361 . . . . 10.0 111.18 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -110.65 115.75 30.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.795 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -129.09 135.96 49.6 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.259 -1.015 . . . . 10.0 108.259 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 65.61 32.67 9.06 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.48 0.488 . . . . 10.0 110.627 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.73 13.9 9.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.523 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -135.01 165.9 24.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.729 0.299 . . . . 10.0 110.73 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 tp -82.58 140.43 33.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.583 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -87.87 146.25 25.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.554 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -88.43 113.76 24.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.64 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -56.96 -29.68 63.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.125 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -76.49 -6.2 83.8 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.592 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -108.77 161.47 15.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.006 0.403 . . . . 10.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 25.8 p -87.4 169.4 12.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.5 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 51.5 mt -60.4 -43.5 96.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.189 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -55.27 -45.32 83.33 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.132 -0.556 . . . . 10.0 112.741 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -66.08 -28.93 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.111 0.412 . . . . 10.0 112.111 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 56.4 m -83.79 11.14 7.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 10.0 112.101 -179.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.87 49.12 7.27 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.763 -0.732 . . . . 10.0 112.777 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -118.48 57.18 0.86 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.169 0.509 . . . . 10.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 14.3 p -76.71 161.6 28.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.728 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.2 p -64.55 -20.04 65.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.489 . . . . 10.0 111.952 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -78.32 -26.98 47.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.778 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -46.04 9.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.065 0.46 . . . . 10.0 109.869 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -104.1 105.49 15.68 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.54 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -116.39 161.13 33.15 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.222 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.58 -19.07 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.219 1.946 . . . . 10.0 110.602 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.57 6.35 34.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.023 -0.989 . . . . 10.0 110.471 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -167.52 85.6 0.78 Allowed Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.925 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.93 147.63 24.29 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.916 2.411 . . . . 10.0 111.669 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.76 117.79 22.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.09 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 130.39 39.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.031 0.443 . . . . 10.0 111.622 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.36 132.41 71.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.05 129.37 9.03 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.846 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.3 tp -110.35 102.14 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.981 0.42 . . . . 10.0 111.962 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.12 132.61 37.1 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.372 -0.973 . . . . 10.0 108.372 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -117.07 119.1 34.22 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.848 -0.341 . . . . 10.0 111.398 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -70.76 117.52 12.38 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.997 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -131.23 149.96 52.35 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.395 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -76.58 126.13 30.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.665 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.87 -35.95 0.32 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.77 0.669 . . . . 10.0 112.567 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 94.63 2.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.869 0.366 . . . . 10.0 110.199 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -79.24 16.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.909 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.33 -25.81 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.48 67.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.699 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.37 -41.62 98.77 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -79.19 -7.85 58.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 mt -106.25 -0.52 9.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.481 0.658 . . . . 10.0 110.035 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.84 106.71 45.59 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -65.83 -12.27 34.52 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.164 2.576 . . . . 10.0 112.146 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -76.6 -25.17 53.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.619 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -116.48 -32.77 5.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 2.0 m -125.03 146.97 55.36 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.483 0.183 . . . . 10.0 110.971 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.07 153.57 57.45 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 122.413 2.075 . . . . 10.0 111.539 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.61 133.67 40.69 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.715 2.276 . . . . 10.0 112.466 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.62 123.8 24.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.436 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 22.9 tp -147.25 128.76 7.31 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.408 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.64 124.14 15.56 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.702 2.268 . . . . 10.0 111.564 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.86 -28.68 69.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.29 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.0 m -68.96 -12.49 16.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.147 0.499 . . . . 10.0 110.811 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 81.4 mmm -120.89 22.34 11.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.773 -0.648 . . . . 10.0 109.734 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -91.48 -51.18 0.31 Allowed Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.5 68.41 6.16 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.349 2.032 . . . . 10.0 112.244 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -132.48 -177.71 4.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.37 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -96.81 169.46 9.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.515 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 135.02 37.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.74 -147.67 7.94 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.972 -0.632 . . . . 10.0 113.372 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -99.27 -26.88 14.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.934 0.397 . . . . 10.0 110.89 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 21.0 m -91.41 163.92 14.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.269 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.45 125.36 25.88 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.676 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.3 t30 70.0 16.01 7.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.508 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -81.3 135.35 35.7 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.98 138.4 52.2 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.098 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -116.54 116.31 27.38 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.7 t -77.86 143.45 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.151 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.731 179.712 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.983 0.421 . . . . 10.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -115.12 128.37 56.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.132 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 34.2 mt -96.37 125.11 40.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.842 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -102.02 117.41 47.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.637 0.256 . . . . 10.0 110.597 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -86.86 161.33 18.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.837 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.47 -24.67 67.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.316 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.31 8.66 8.6 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.694 0.283 . . . . 10.0 111.176 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.05 43.82 25.47 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 110.774 -0.93 . . . . 10.0 110.774 -179.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -113.53 141.48 47.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.264 . . . . 10.0 110.451 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -112.27 131.43 55.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.236 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -124.1 104.73 9.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.652 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 8.9 mm -87.16 115.08 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -101.13 129.39 52.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 110.092 -0.336 . . . . 10.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -59.47 128.33 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -50.74 -35.96 34.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.47 0.545 . . . . 10.0 112.47 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -50.45 -46.67 56.78 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.333 0.396 . . . . 10.0 111.735 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -85.83 -27.71 24.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.164 0.507 . . . . 10.0 110.717 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.26 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.157 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.5 -49.04 75.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 10.0 110.215 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -40.22 90.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.622 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 18.9 m -63.5 -35.34 80.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.081 0.467 . . . . 10.0 110.459 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.64 -5.0 85.87 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.068 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 10.1 m -89.22 -27.23 20.76 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.359 0.6 . . . . 10.0 109.81 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 12.6 mt -75.65 153.3 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.678 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.11 85.34 1.03 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.089 0.471 . . . . 10.0 110.433 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -97.32 177.45 5.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.066 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.9 mmm -80.71 35.31 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.151 0.426 . . . . 10.0 112.151 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mp -69.06 -28.74 66.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.246 0.546 . . . . 10.0 109.9 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.37 14.33 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.05 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -74.78 -58.99 3.88 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.749 -0.66 . . . . 10.0 112.84 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.95 166.16 14.84 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.556 2.17 . . . . 10.0 112.246 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -49.1 79.0 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.831 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -147.57 115.04 6.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.698 0.285 . . . . 10.0 110.564 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -85.03 91.46 8.09 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.867 -0.419 . . . . 10.0 109.867 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.6 166.69 23.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.575 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.13 -32.12 73.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.619 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -63.94 -38.28 90.49 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.24 -24.32 61.36 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.91 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -74.96 -30.38 61.19 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -84.32 -52.96 5.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.26 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -124.94 100.36 6.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.904 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -85.01 114.93 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.986 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -93.17 114.74 27.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.96 0.41 . . . . 10.0 111.117 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -93.68 151.93 19.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.881 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -125.05 130.44 52.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.829 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 69.74 8.54 6.77 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.815 -0.63 . . . . 10.0 112.083 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 61.4 mt -105.44 114.58 63.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.692 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -73.06 142.78 34.99 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.931 2.421 . . . . 10.0 111.708 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.7 p -60.9 -33.37 73.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.66 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -51.9 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.936 -0.574 . . . . 10.0 111.667 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.7 m -78.67 -27.65 14.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.721 0.296 . . . . 10.0 111.268 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 40.3 tp -65.79 -32.88 74.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.074 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 84.5 p -61.28 -39.3 89.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.637 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -65.93 -32.83 74.55 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.655 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.07 -47.64 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 10.9 m -62.93 -40.07 96.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.797 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 54.8 ttm -63.26 -45.74 90.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.252 -0.885 . . . . 10.0 110.431 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -63.52 -41.76 98.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.767 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -61.88 -45.07 95.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.379 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 51.4 m -59.98 -42.12 93.49 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.304 0.574 . . . . 10.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.51 -41.63 96.3 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.404 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 tptt -63.11 -39.27 94.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.18 -0.464 . . . . 10.0 111.042 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 71.1 t -59.2 -48.42 86.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.126 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -70.7 -41.01 72.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.157 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -57.61 -43.74 84.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.257 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 24.99 2.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.144 0.497 . . . . 10.0 111.267 -179.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -135.53 -58.52 0.78 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.627 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.39 -28.8 2.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.322 0.49 . . . . 10.0 112.322 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -86.93 32.93 0.66 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.37 5.48 20.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 10.0 111.048 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -103.69 -3.38 25.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.963 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 40.0 pt -111.36 167.23 9.37 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.118 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.74 170.86 18.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.39 2.06 . . . . 10.0 113.08 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -70.01 168.15 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.565 -0.743 . . . . 10.0 109.609 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -51.64 134.61 35.39 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 123.202 0.314 . . . . 10.0 110.647 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.7 121.52 8.12 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.067 2.511 . . . . 10.0 112.718 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 26.6 pt -84.25 44.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.799 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.64 -53.94 0.14 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 112.768 0.655 . . . . 10.0 112.768 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.96 112.71 2.56 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.087 1.858 . . . . 10.0 112.598 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.07 55.48 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.335 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 mm -120.36 -11.7 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 10.0 111.253 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.36 82.57 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.44 -30.73 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 10.0 110.282 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -62.33 -35.95 80.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.877 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 75.2 mt -76.39 -31.58 58.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.845 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.71 -27.49 68.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.351 -0.841 . . . . 10.0 110.614 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 19.8 ttp -60.51 -19.18 56.14 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.904 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.94 -34.19 74.33 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.689 -0.232 . . . . 10.0 111.106 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.69 -57.64 0.5 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.208 0.818 . . . . 10.0 113.208 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -81.91 38.6 0.53 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.954 0.407 . . . . 10.0 111.657 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--O 1.244 0.806 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 179.229 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.578 -0.209 . . . . 10.0 112.578 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -59.22 4.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.743 0.646 . . . . 10.0 112.743 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 24.8 tp -62.04 -31.77 72.21 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.891 0.377 . . . . 10.0 110.836 -178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -56.34 -33.85 66.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.786 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -97.27 -40.36 8.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.891 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.61 -39.33 87.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.953 -0.567 . . . . 10.0 112.441 -179.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.43 -36.58 81.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 10.0 111.155 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 tp -69.89 -37.3 75.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.178 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.46 -22.03 61.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.352 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.54 -51.49 7.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.087 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -141.61 112.92 7.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.524 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.7 mt -80.63 93.53 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.22 -1.03 . . . . 10.0 108.22 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -106.19 94.15 9.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.678 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -87.19 88.98 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.995 2.463 . . . . 10.0 110.683 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -138.43 -176.79 4.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.992 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -89.11 158.94 17.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.192 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.3 mm -100.68 162.45 3.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.406 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -177.75 128.14 0.3 Allowed Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -39.44 138.07 0.84 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.739 2.959 . . . . 10.0 113.421 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.74 138.14 84.61 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.965 2.444 . . . . 10.0 112.211 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.53 121.74 85.22 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.456 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -62.38 -23.63 75.23 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.886 2.391 . . . . 10.0 112.248 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -35.38 77.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.247 0.546 . . . . 10.0 109.975 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -116.07 -132.78 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.355 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -160.75 52.69 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.327 0.584 . . . . 10.0 109.989 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -154.6 149.32 26.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.843 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.77 156.08 38.21 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.506 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -171.52 1.99 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.502 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -130.38 129.11 42.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -169.28 -63.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.073 0.463 . . . . 10.0 110.609 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.79 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-N 114.757 -1.11 . . . . 10.0 109.006 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tmm? . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.568 0.223 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.98 137.03 33.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.309 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 88.5 t -125.3 124.93 68.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.124 0.488 . . . . 10.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -111.54 112.84 24.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.142 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -131.43 163.01 28.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.798 0.333 . . . . 10.0 111.191 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 34.7 mtm -128.54 108.27 10.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.2 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 49.7 mm -81.62 98.99 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.44 -0.948 . . . . 10.0 108.44 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -98.58 103.54 15.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 113.016 0.747 . . . . 10.0 113.016 -178.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 27.5 ttp85 -89.27 72.09 8.16 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.102 -1.444 . . . . 10.0 107.102 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 67.87 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.058 -0.974 . . . . 10.0 110.139 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -107.94 -12.6 15.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.799 0.333 . . . . 10.0 111.108 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -95.65 91.75 6.27 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.094 -0.336 . . . . 10.0 110.094 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.2 m -94.57 120.24 34.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.005 0.431 . . . . 10.0 110.815 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.99 119.38 58.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.685 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -74.34 117.22 15.9 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.33 112.3 24.67 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.201 0.524 . . . . 10.0 111.813 -178.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -104.44 101.66 11.34 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.67 -167.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.871 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -123.48 161.7 24.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.47 -26.03 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.871 0.367 . . . . 10.0 111.63 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.82 -15.28 60.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.89 -0.596 . . . . 10.0 111.625 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 9.2 m -74.85 143.76 43.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.258 . . . . 10.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -94.94 165.9 12.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.822 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.99 -37.42 79.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.815 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -62.93 -35.1 78.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.451 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.94 -36.11 82.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.419 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.6 mt -62.01 -44.6 96.37 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.04 -40.31 93.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.963 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -64.86 -37.15 86.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.272 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.13 -47.02 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.9 t -64.46 -33.74 64.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.248 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -57.86 -40.02 79.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.629 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.53 -2.52 90.54 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.654 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.1 mt -106.8 -51.6 7.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.944 0.402 . . . . 10.0 111.281 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.58 -7.67 49.54 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.238 0.459 . . . . 10.0 112.238 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 62.39 29.48 17.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.932 0.396 . . . . 10.0 111.422 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -114.99 136.63 22.61 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.19 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.94 128.8 31.76 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.282 2.654 . . . . 10.0 112.684 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.57 -14.46 36.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.384 2.723 . . . . 10.0 111.812 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.78 -43.72 85.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -99.12 14.54 28.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.921 -0.581 . . . . 10.0 112.096 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -87.07 127.2 35.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.211 -0.45 . . . . 10.0 109.929 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 31.8 mmt-85 -115.34 115.2 26.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.29 115.09 27.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.224 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.16 111.6 22.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.06 0.457 . . . . 10.0 111.819 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -111.21 128.35 55.89 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.977 -1.12 . . . . 10.0 107.977 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 60.99 32.06 19.92 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.29 0.567 . . . . 10.0 109.776 -179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 68.34 17.45 9.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.148 -0.933 . . . . 10.0 111.791 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -125.31 149.99 47.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.071 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 28.8 tp -79.22 136.97 37.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.627 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 86.5 mt -86.26 174.86 8.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 10.0 111.736 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -110.57 125.48 53.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -62.26 -27.64 69.15 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -178.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.63 2.11 79.79 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.686 -0.768 . . . . 10.0 113.973 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -105.14 148.7 26.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.081 0.44 . . . . 10.0 111.282 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 34.7 p -83.85 166.85 17.58 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.882 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.3 mt -57.94 -41.53 82.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.406 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.82 93.74 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.795 -0.717 . . . . 10.0 111.81 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.87 -24.59 65.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.768 0.318 . . . . 10.0 111.157 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 84.8 m -84.53 5.04 29.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.927 0.394 . . . . 10.0 111.854 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.76 14.67 60.82 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.679 -0.772 . . . . 10.0 114.149 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -87.17 79.43 8.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 117.134 0.467 . . . . 10.0 110.748 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 73.3 p -97.64 167.67 10.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.51 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 10.0 111.281 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -77.08 -35.37 56.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.739 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -90.05 -32.73 16.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.042 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.09 98.87 8.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.272 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -114.73 155.26 46.45 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.297 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.48 -16.49 55.41 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.229 1.952 . . . . 10.0 111.342 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -106.2 -1.03 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.466 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -158.04 88.44 2.39 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.879 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -78.3 140.18 17.2 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.821 2.348 . . . . 10.0 111.18 179.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.25 114.55 6.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 10.0 111.459 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.75 114.05 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.497 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 51.4 t -116.42 133.54 62.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.05 135.42 13.69 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.2 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 36.8 tp -114.38 107.06 15.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.792 0.33 . . . . 10.0 111.351 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.69 145.17 28.77 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -125.13 114.75 19.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -77.88 99.78 6.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.13 0.49 . . . . 10.0 111.44 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.74 128.54 54.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.21 131.91 51.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.822 0.304 . . . . 10.0 111.822 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 9.5 t70 73.27 -0.3 3.42 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.62 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 10.9 m -104.28 100.28 10.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.12 0.486 . . . . 10.0 110.518 179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -67.78 -10.23 50.89 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.704 0.631 . . . . 10.0 112.704 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.17 -22.84 63.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.942 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.02 -29.85 68.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.043 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 65.3 mt -83.73 -32.42 25.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.76 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.1 m -66.19 -37.08 84.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.741 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 mt -92.3 11.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.889 0.376 . . . . 10.0 111.585 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.5 101.49 17.63 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.821 0.343 . . . . 10.0 110.652 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -63.84 -10.17 21.6 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.411 2.74 . . . . 10.0 112.8 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.01 -28.8 35.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.048 0.452 . . . . 10.0 110.999 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 11.8 m -113.84 -21.16 10.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.925 0.393 . . . . 10.0 111.596 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 8.8 m -126.57 149.25 67.47 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.376 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.89 162.42 41.98 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.634 2.223 . . . . 10.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.19 150.09 71.26 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.43 2.086 . . . . 10.0 111.652 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.55 84.41 3.93 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.291 0.567 . . . . 10.0 110.915 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 34.5 tp -108.49 122.46 40.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.24 130.31 23.73 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.754 2.302 . . . . 10.0 111.06 179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -35.71 81.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.025 0.441 . . . . 10.0 111.145 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.07 -18.48 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.753 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 90.0 mmm -111.53 28.55 8.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.754 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.76 -51.04 0.25 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 112.807 0.669 . . . . 10.0 112.807 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -72.9 56.54 3.01 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 122.593 2.195 . . . . 10.0 112.403 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -132.29 127.91 36.64 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -73.98 146.77 43.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.859 0.361 . . . . 10.0 111.913 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.7 m -63.82 139.05 58.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.745 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.21 -117.62 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.867 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.66 -37.94 6.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.997 0.427 . . . . 10.0 111.089 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 13.8 m -95.13 169.78 9.87 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.782 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.46 142.1 39.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 70.92 -5.49 1.48 Allowed 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.573 0.546 . . . . 10.0 111.361 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -84.64 112.08 20.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.263 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -106.72 143.66 34.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.255 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.18 114.29 26.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -71.91 132.25 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.057 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.086 0.469 . . . . 10.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.683 0.278 . . . . 10.0 111.083 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -113.2 113.43 25.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.45 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 40.0 mt -90.46 121.46 32.45 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 42.1 mt -106.04 130.0 58.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.088 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -101.3 170.63 8.11 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.625 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -59.15 -24.6 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -81.65 -2.65 51.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.319 . . . . 10.0 111.454 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.66 12.64 74.59 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.812 -0.709 . . . . 10.0 111.561 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.48 124.45 28.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.86 121.83 41.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.018 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -113.51 112.55 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.777 0.323 . . . . 10.0 111.504 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 13.8 mm -89.54 119.25 36.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.2 t -104.55 134.99 44.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 69.2 tttt -62.69 128.94 38.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 29.8 ttt180 -52.27 -38.04 57.13 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.379 0.424 . . . . 10.0 112.098 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -54.59 -44.17 72.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.924 0.392 . . . . 10.0 111.206 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -80.22 -35.06 36.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.169 0.509 . . . . 10.0 110.215 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.36 87.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.51 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 74.6 mt -58.71 -50.67 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.585 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.26 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.486 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.2 m -64.99 -34.65 78.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.167 0.508 . . . . 10.0 109.858 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.87 -2.05 90.0 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.824 -0.625 . . . . 10.0 112.291 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -88.59 -23.4 23.12 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 17.3 mt -80.76 152.78 4.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -72.26 80.86 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 10.0 110.769 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.33 165.98 14.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.42 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 85.5 mmm -78.85 40.4 0.39 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.26 -24.76 64.02 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.344 -0.614 . . . . 10.0 109.344 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.33 14.36 13.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.01 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.22 -61.73 6.99 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 115.835 -0.621 . . . . 10.0 113.138 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -71.49 -165.87 0.22 Allowed 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.679 2.253 . . . . 10.0 112.243 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.0 -51.57 10.17 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.589 -0.815 . . . . 10.0 112.219 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -144.15 142.53 30.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.82 0.343 . . . . 10.0 110.233 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -114.22 88.45 2.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.757 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.84 161.53 30.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.077 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.35 -31.0 69.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.331 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -64.11 -38.5 91.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.152 0.501 . . . . 10.0 110.254 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -73.4 -24.69 60.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.637 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -78.34 -11.63 59.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.051 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -86.46 -55.34 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.674 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -129.75 91.65 3.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.359 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 t -78.24 124.38 36.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.309 -0.405 . . . . 10.0 109.961 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -98.79 106.26 18.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 10.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -88.05 91.35 8.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.159 0.504 . . . . 10.0 110.939 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -76.09 134.91 39.9 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.29 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 77.47 4.6 3.1 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 124.018 0.824 . . . . 10.0 112.174 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 72.8 mt -109.18 115.97 55.9 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.549 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -67.31 151.25 80.99 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 123.104 2.536 . . . . 10.0 111.926 179.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.1 p -63.0 -37.87 88.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.64 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -55.66 -55.27 34.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.901 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.6 -31.6 53.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.627 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 25.8 tp -65.54 -40.01 92.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.934 0.397 . . . . 10.0 110.102 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -62.32 -34.93 77.58 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.113 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -64.95 -39.81 94.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.894 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.73 -49.22 76.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.361 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 63.3 m -57.01 -41.39 78.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.158 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -64.51 -41.11 96.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.128 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -65.48 -41.83 92.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.652 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -63.57 -45.04 92.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.286 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 46.4 m -59.33 -43.97 92.67 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.451 0.643 . . . . 10.0 109.68 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -63.76 -44.59 93.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.135 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -61.39 -40.39 94.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.938 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.16 -52.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.858 0.361 . . . . 10.0 110.589 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.2 mmt85 -70.81 -38.24 73.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.248 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -56.73 -50.24 72.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.045 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.84 -13.33 59.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.87 0.367 . . . . 10.0 111.84 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -88.64 -44.82 10.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 68' ' ' SER . . . . . 0.433 ' C ' ' H ' ' C' ' 70' ' ' THR . 0.6 OUTLIER -154.39 -31.0 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.873 0.694 . . . . 10.0 112.873 -179.258 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 29.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 70' ' ' THR . . . . . 0.433 ' H ' ' C ' ' C' ' 68' ' ' SER . 0.2 OUTLIER -80.1 -1.22 39.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.216 0.531 . . . . 10.0 110.399 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -76.5 -24.52 53.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.396 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 31.7 pt -96.13 166.17 14.87 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.428 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.86 175.74 8.58 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.928 2.419 . . . . 10.0 112.661 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -72.59 171.72 11.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.476 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -50.77 128.6 27.18 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.675 0.274 . . . . 10.0 111.043 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -53.89 128.01 27.91 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.185 2.59 . . . . 10.0 112.979 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 17.1 pt -85.48 41.72 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.149 0.499 . . . . 10.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -90.96 -55.89 0.26 Allowed Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.96 -0.563 . . . . 10.0 112.456 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -72.14 128.58 14.05 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.888 1.725 . . . . 10.0 111.011 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -75.2 0.46 16.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.0 mm -85.85 99.35 7.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.272 0.558 . . . . 10.0 111.35 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.02 -42.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.049 -0.978 . . . . 10.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 29.1 tp -65.84 -26.86 67.85 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -62.91 -31.84 72.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.9 -1.045 . . . . 10.0 109.884 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 66.4 mt -79.72 -35.12 39.41 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -23.99 67.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.403 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 49.5 ttp -58.99 -28.95 66.85 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.269 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.03 -43.07 86.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.16 -52.42 0.59 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.164 1.172 . . . . 10.0 114.164 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -79.61 25.15 0.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.294 0.479 . . . . 10.0 112.294 -178.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 . . . . . 0 C--O 1.244 0.791 0 CA-C-O 118.699 -0.667 . . . . 10.0 109.625 179.557 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -62.89 1.53 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 37.3 tp -61.01 -34.01 74.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.982 -179.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.53 -30.23 66.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.133 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -98.63 -38.32 9.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.02 0.438 . . . . 10.0 110.473 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 77.5 mt -63.4 -35.7 81.29 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.94 -0.573 . . . . 10.0 112.233 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.38 92.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 10.0 110.329 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.99 -22.83 62.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.125 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.17 -9.54 59.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.309 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.14 -51.16 3.08 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.407 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.2 129.11 29.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.736 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 mp -91.28 97.65 7.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -111.53 103.68 55.32 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.951 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -97.05 45.17 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.429 2.753 . . . . 10.0 111.611 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -93.28 -178.08 4.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.413 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -82.33 147.86 28.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.21 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.7 mm -110.33 106.45 20.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.15 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -121.87 135.49 25.32 Favored Pre-proline 0 C--N 1.32 -0.695 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -34.25 135.12 0.13 Allowed 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 124.176 3.251 . . . . 10.0 113.6 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -56.64 141.09 91.49 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 123.293 2.662 . . . . 10.0 112.511 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.81 118.42 72.31 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.763 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.98 -21.27 64.22 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.391 2.727 . . . . 10.0 113.165 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -63.97 -34.55 78.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.818 0.342 . . . . 10.0 111.095 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.3 t -122.68 -112.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -175.21 61.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.185 0.517 . . . . 10.0 111.095 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -159.85 151.87 20.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.447 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -70.76 156.64 39.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.818 0.342 . . . . 10.0 110.744 179.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.01 170.81 7.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.107 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -119.88 111.89 18.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.844 0.354 . . . . 10.0 110.741 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.57 -72.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.183 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.41 -62.63 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.309 -0.853 . . . . 10.0 109.511 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.877 0.37 . . . . 10.0 111.022 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -166.69 121.72 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.671 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.27 117.14 48.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.996 0.427 . . . . 10.0 110.856 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -104.25 115.47 30.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.653 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.71 156.33 45.12 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.892 0.377 . . . . 10.0 111.37 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 55.2 mtm -125.61 111.81 15.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.874 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -82.19 104.32 10.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -100.27 97.39 8.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.0 ttp85 -89.19 75.71 7.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.7 -1.222 . . . . 10.0 107.7 177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 67.13 -87.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.448 -178.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -113.67 11.09 18.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 10.0 111.001 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.8 m -116.61 96.92 5.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.383 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 24.6 m -96.13 121.14 37.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.897 0.38 . . . . 10.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 51.1 mt -112.21 119.19 59.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.358 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.16 122.84 26.18 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.2 m -116.6 118.39 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.036 0.446 . . . . 10.0 112.003 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -103.4 101.58 11.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.96 -169.4 2.03 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.275 0.36 . . . . 10.0 110.784 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -127.54 163.82 23.33 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.6 -25.83 64.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -18.94 60.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.839 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.8 m -71.68 141.26 49.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.615 -0.266 . . . . 10.0 110.729 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 20.3 p -91.78 163.96 13.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.625 -0.261 . . . . 10.0 110.63 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.78 -36.32 76.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.925 0.393 . . . . 10.0 110.577 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -61.29 -36.13 79.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.645 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -63.33 -34.26 77.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.171 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.58 -42.58 99.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.0 -32.03 73.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.283 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.0 mtp180 -66.08 -39.5 90.09 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 70.1 mt -67.33 -43.46 87.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -61.57 -38.09 79.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.432 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.41 -30.12 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.537 . . . . 10.0 110.271 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.73 -0.14 86.2 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.869 -0.682 . . . . 10.0 112.362 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.9 mt -115.64 -55.29 4.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 10.0 111.079 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 66.4 mt -88.42 -11.5 45.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.453 -0.339 . . . . 10.0 111.138 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.4 mttt 55.7 52.84 10.31 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.918 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.63 146.57 62.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.689 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -54.49 121.76 10.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.963 2.442 . . . . 10.0 112.268 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.74 -16.65 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.783 2.322 . . . . 10.0 111.928 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -26.75 65.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.387 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -101.22 9.62 41.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.229 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -95.03 131.12 41.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 56.8 mmt-85 -117.9 114.26 22.96 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 82.1 mt -94.15 117.77 30.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.779 0.324 . . . . 10.0 110.56 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -111.44 124.5 52.39 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 112.268 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 38.9 tttm -127.22 128.34 45.9 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 61.59 31.66 18.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.899 0.381 . . . . 10.0 110.642 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 70.91 13.44 7.04 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.378 -0.828 . . . . 10.0 111.89 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -124.25 144.89 49.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.804 0.335 . . . . 10.0 111.039 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 42.4 tp -73.26 127.69 33.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.502 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 97.1 mt -70.46 155.76 40.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.027 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -87.27 118.21 26.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.647 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.81 -28.1 68.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.825 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.91 24.39 32.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.454 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 mttp -127.78 160.16 32.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.963 0.411 . . . . 10.0 111.02 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 35.0 p -89.12 166.59 13.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.215 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.35 -40.53 86.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.01 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.07 -39.9 96.38 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.875 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -72.83 -17.39 61.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.962 0.41 . . . . 10.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 60.2 m -94.91 5.96 50.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.728 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.52 16.89 63.17 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.71 -0.757 . . . . 10.0 113.355 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -84.64 63.62 8.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.151 0.5 . . . . 10.0 110.451 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 3.5 p -84.85 149.83 25.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.12 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 2.3 m -62.49 -21.58 65.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.992 0.425 . . . . 10.0 110.673 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -63.76 -30.26 71.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.208 -0.451 . . . . 10.0 109.904 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.16 5.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.751 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -90.58 87.84 6.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.164 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -100.11 159.55 29.51 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.112 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.86 -16.76 55.84 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.638 2.225 . . . . 10.0 111.897 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.67 5.95 16.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.442 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.423 ' CB ' ' H ' ' B' ' 112' ' ' ALA . . . -156.26 79.05 4.08 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.339 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.29 141.78 29.37 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.612 2.208 . . . . 10.0 111.545 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.09 123.53 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.069 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 123.6 24.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.571 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 21.0 t -123.77 129.19 74.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.55 133.43 11.8 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.697 -0.763 . . . . 10.0 111.896 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.4 tp -110.29 99.1 8.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.009 0.433 . . . . 10.0 111.116 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -95.65 114.3 26.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.013 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -97.84 118.77 35.15 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -83.46 100.86 11.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.146 0.498 . . . . 10.0 111.244 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -120.36 141.11 50.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.695 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.61 137.51 54.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 4.7 t70 70.79 11.81 7.16 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.409 0.623 . . . . 10.0 110.854 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 9.4 m -111.68 98.85 7.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.214 0.531 . . . . 10.0 111.063 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -72.78 -17.92 61.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.576 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.98 -26.05 59.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.641 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.67 -16.8 61.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.71 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 58.7 mt -93.4 -15.57 25.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.949 0.404 . . . . 10.0 111.345 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 24.0 m -91.93 -30.26 16.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.115 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 7.2 mt -85.45 -3.3 8.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.29 0.567 . . . . 10.0 110.597 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -100.38 110.29 59.59 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.152 -0.477 . . . . 10.0 111.079 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.72 -1.67 10.71 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.027 2.485 . . . . 10.0 111.736 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -84.57 -24.37 29.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.195 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -112.79 -39.4 4.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.599 -0.728 . . . . 10.0 111.064 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 25.5 m -117.34 155.62 49.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.978 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.16 154.98 42.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.558 2.172 . . . . 10.0 111.912 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.44 135.22 68.15 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.855 2.37 . . . . 10.0 112.014 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -76.69 106.08 8.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.316 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.4 tp -141.64 121.29 8.2 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.687 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -64.81 133.15 35.13 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.535 2.157 . . . . 10.0 111.687 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -60.72 -27.67 68.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.53 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 18.1 m -65.02 -25.14 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.279 0.561 . . . . 10.0 110.586 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 83.4 mmm -121.47 54.88 1.1 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.281 -1.007 . . . . 10.0 108.281 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -126.87 -54.96 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.465 -0.789 . . . . 10.0 112.445 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -82.23 70.11 7.18 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.633 2.222 . . . . 10.0 111.645 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -128.64 -167.41 1.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.796 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -93.41 179.78 5.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 8.6 m -110.7 136.57 49.58 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.66 0.267 . . . . 10.0 110.402 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -86.35 -147.71 11.07 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.511 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 3.6 m -111.66 -22.47 11.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.334 0.588 . . . . 10.0 110.348 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -86.63 159.79 19.1 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.604 -0.725 . . . . 10.0 109.918 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . 0.423 ' H ' ' CB ' ' B' ' 71' ' ' ALA . . . -64.4 121.95 15.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 t30 69.94 17.28 7.51 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.782 0.677 . . . . 10.0 111.572 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -81.78 129.54 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.995 0.426 . . . . 10.0 110.249 179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -110.13 143.04 40.79 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.097 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.09 105.76 13.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.353 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.9 t -72.38 137.65 23.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.911 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.5 mp0 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.494 179.635 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.89 0.376 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -104.16 108.36 19.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.174 -0.467 . . . . 10.0 111.181 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 47.8 mt -81.8 126.66 32.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.9 mt -108.13 114.14 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.813 0.34 . . . . 10.0 110.582 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.66 165.66 16.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.674 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m -61.65 -25.68 67.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.908 0.385 . . . . 10.0 111.655 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -79.02 0.15 28.86 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.647 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.71 26.22 59.15 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -91.08 138.79 31.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.44 . . . . 10.0 110.381 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.58 132.53 49.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.316 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -125.12 106.85 10.22 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.257 -0.428 . . . . 10.0 109.983 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 27.4 mm -88.68 110.81 21.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.148 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 43.1 t -98.51 125.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.04 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -59.74 128.25 35.99 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.298 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.0 ttt-85 -53.28 -31.26 42.94 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.33 -0.395 . . . . 10.0 111.639 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -52.34 -44.8 65.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.078 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -87.09 -30.03 21.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.514 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.44 73.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.025 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.1 -46.87 87.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.739 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 4.6 m -72.61 -36.21 68.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.408 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 27.5 m -65.26 -24.07 67.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.146 0.498 . . . . 10.0 110.301 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.71 -8.33 82.96 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.694 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -87.74 -19.57 27.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.454 0.645 . . . . 10.0 109.584 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -79.21 148.35 6.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.313 -0.858 . . . . 10.0 109.312 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.7 79.8 0.84 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 10.0 110.697 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.01 172.87 8.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.313 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.8 mmm -82.87 38.59 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.11 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mp -66.8 -32.57 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.288 0.566 . . . . 10.0 109.811 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -90.17 14.54 12.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.957 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.56 -62.5 3.83 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.657 -0.701 . . . . 10.0 112.89 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.99 -167.5 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.726 2.284 . . . . 10.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.63 -90.01 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.962 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -116.08 132.33 56.69 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.706 -0.291 . . . . 10.0 110.534 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.76 92.95 8.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.306 -0.406 . . . . 10.0 109.987 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.73 176.51 8.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.187 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.37 -25.74 68.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.268 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.86 -48.07 78.18 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -70.46 -24.45 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.246 -0.888 . . . . 10.0 111.324 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 5.1 m -78.29 -47.05 18.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.017 0.437 . . . . 10.0 110.621 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -70.83 -44.16 67.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.878 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -128.62 103.27 7.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.436 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 104.69 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -84.22 128.5 34.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.669 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -109.15 124.43 50.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.345 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -96.41 128.1 43.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.334 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 67.48 19.76 9.93 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 10.0 112.79 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 67.2 mt -113.45 111.4 49.54 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.212 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.7 143.57 46.68 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 123.038 2.492 . . . . 10.0 111.645 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -34.9 70.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.904 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.11 -55.54 31.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 10.0 111.742 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.6 m -71.33 -30.42 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.99 -0.284 . . . . 10.0 111.002 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 43.9 tp -64.34 -35.9 82.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.447 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -59.59 -39.76 85.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.589 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -65.73 -36.18 82.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.315 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 36.3 t -68.53 -44.28 83.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.64 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.28 -42.3 98.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.614 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 72.1 mtm -66.4 -35.21 79.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.467 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -65.21 -42.65 93.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.174 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -62.39 -47.44 84.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.703 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.0 m -57.53 -42.46 82.92 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.944 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -64.48 -45.57 86.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.364 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptt -63.79 -34.83 78.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 112.006 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.01 -40.76 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.102 0.477 . . . . 10.0 110.52 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -84.52 -34.45 23.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.737 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -57.71 -57.33 13.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.027 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.97 54.47 3.1 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -162.16 -58.87 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.322 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.58 -33.82 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.634 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -87.12 35.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.082 0.468 . . . . 10.0 111.949 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -9.76 59.09 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.012 0.434 . . . . 10.0 110.535 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -92.95 -9.54 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.658 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 34.1 pt -100.17 164.36 16.53 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.155 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.61 164.23 27.2 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.625 2.217 . . . . 10.0 112.948 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.63 170.63 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.315 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -48.15 128.24 12.3 Favored Pre-proline 0 C--O 1.233 0.197 0 O-C-N 123.295 0.372 . . . . 10.0 110.824 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.96 121.77 5.45 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.545 2.83 . . . . 10.0 113.395 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 2.7 pt -80.15 45.81 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.576 -0.738 . . . . 10.0 111.855 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -102.21 -57.5 0.1 Allowed Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 112.724 0.639 . . . . 10.0 112.724 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.37 97.01 1.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.202 1.935 . . . . 10.0 111.59 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.28 59.81 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.684 0.624 . . . . 10.0 112.684 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.1 mm -116.25 13.73 7.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.879 0.847 . . . . 10.0 108.942 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.56 -38.43 54.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.328 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.58 -30.07 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.137 0.494 . . . . 10.0 110.126 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 -61.42 -35.77 78.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.397 -0.82 . . . . 10.0 109.827 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.73 -33.55 35.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.335 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.13 -27.15 69.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.685 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.2 ttp -59.5 -20.73 57.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.767 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -42.06 88.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.606 0.241 . . . . 10.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.59 -50.94 0.51 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -79.98 12.15 2.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.883 0.373 . . . . 10.0 111.586 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.329 179.863 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.316 -0.314 . . . . 10.0 112.316 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -67.93 0.28 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.164 0.801 . . . . 10.0 113.164 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.95 -32.31 73.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.585 -0.279 . . . . 10.0 111.514 -178.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -57.6 -42.77 83.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.041 0.448 . . . . 10.0 110.25 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -78.88 -40.28 32.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.994 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.02 -32.77 72.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.62 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.86 -43.52 92.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.791 0.329 . . . . 10.0 110.544 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 tp -70.27 -22.73 62.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.44 0.638 . . . . 10.0 109.956 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.77 2.23 56.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.368 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -114.07 -39.41 3.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.157 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -156.68 118.91 3.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.016 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.1 mt -86.48 85.57 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 ttpt -96.21 111.89 57.98 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.159 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -95.46 36.04 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.315 2.677 . . . . 10.0 111.352 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -82.29 -177.95 6.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.341 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -87.35 166.03 15.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.547 0.573 . . . . 10.0 112.547 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.0 mm -116.41 143.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.691 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.83 143.03 2.52 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -43.74 140.28 4.72 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.258 2.639 . . . . 10.0 112.526 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.84 139.28 67.64 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.859 2.373 . . . . 10.0 111.826 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 125.72 87.19 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.66 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.59 -11.03 30.09 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.097 2.531 . . . . 10.0 112.936 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -42.38 76.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.135 0.493 . . . . 10.0 110.478 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -119.5 -125.51 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -159.41 55.56 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.38 0.61 . . . . 10.0 110.727 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.9 tttm -153.06 154.11 34.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.408 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.52 156.38 32.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.716 0.293 . . . . 10.0 110.935 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.53 169.91 9.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.601 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -122.32 119.41 31.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.03 0.443 . . . . 10.0 110.967 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -153.17 -68.25 0.15 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.991 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.413 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.0 -56.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.806 -0.616 . . . . 10.0 109.875 179.908 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tmm? . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 121.02 0.438 . . . . 10.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -79.23 137.17 37.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.003 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 98.3 t -123.6 119.49 57.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.29 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -109.3 115.03 29.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.994 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.13 159.75 36.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.811 0.339 . . . . 10.0 111.39 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 35.0 mtm -127.52 106.17 8.99 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.862 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 45.8 mm -78.36 105.39 7.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -107.62 104.15 13.62 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 -178.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -92.54 76.39 5.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.339 -1.356 . . . . 10.0 107.339 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 67.6 -81.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.428 -0.805 . . . . 10.0 111.083 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 mttt -113.87 -12.65 12.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.94 0.4 . . . . 10.0 111.743 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.5 105.14 17.37 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.6 m -106.68 120.48 42.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.63 0.253 . . . . 10.0 111.24 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 58.3 mt -113.44 118.09 57.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.81 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -77.26 118.42 19.73 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -110.02 116.74 32.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.448 0.642 . . . . 10.0 112.003 -178.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -101.59 97.99 8.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.706 -1.22 . . . . 10.0 107.706 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.44 -169.69 1.9 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.222 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -127.43 158.49 37.2 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.73 -20.7 61.81 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.467 0.543 . . . . 10.0 112.467 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.19 -15.29 58.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.835 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 20.1 m -81.09 143.27 32.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.742 0.306 . . . . 10.0 111.367 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -90.55 168.28 11.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.455 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 57.2 t -64.63 -34.32 69.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.638 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -62.2 -35.94 80.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.412 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -63.5 -29.8 71.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.105 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 81.1 mt -67.21 -47.31 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.514 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 91.3 mttt -61.36 -33.34 73.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.877 -0.602 . . . . 10.0 110.573 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.55 -34.31 77.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.138 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.1 mt -70.57 -46.85 68.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.67 -36.41 73.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.327 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -57.58 -40.25 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.69 -14.66 79.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.85 -0.691 . . . . 10.0 113.241 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 88.0 mt -95.42 -51.94 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 122.663 -0.316 . . . . 10.0 111.399 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 46.1 mt -85.54 -11.63 53.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.452 0.538 . . . . 10.0 112.452 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.7 mttm 60.92 41.24 14.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -131.82 151.55 78.76 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.85 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.42 131.51 46.67 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.308 2.672 . . . . 10.0 112.589 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.95 -20.9 11.33 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.877 2.384 . . . . 10.0 111.971 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -70.68 -23.74 62.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -98.87 11.41 38.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.349 0.595 . . . . 10.0 111.194 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -99.42 133.33 43.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.469 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 47.5 mmt-85 -115.0 118.22 32.8 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 41.1 mt -96.93 114.18 25.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.844 0.354 . . . . 10.0 111.144 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -112.33 127.23 55.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.137 0.494 . . . . 10.0 111.569 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -137.22 128.82 28.57 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.31 39.05 15.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.91 0.386 . . . . 10.0 111.214 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 64.27 17.06 10.51 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.353 -0.839 . . . . 10.0 111.808 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -128.72 155.19 45.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.858 0.361 . . . . 10.0 111.286 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.94 133.71 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.9 mt -76.77 155.95 32.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.835 0.35 . . . . 10.0 111.511 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -100.95 114.1 27.69 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.366 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.514 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 2.3 m-20 -64.86 -15.7 62.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.725 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.88 14.54 64.55 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.885 -0.674 . . . . 10.0 112.751 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -130.72 160.9 32.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.753 0.311 . . . . 10.0 110.693 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 43.4 p -86.6 165.56 16.09 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.405 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 84.7 mt -57.63 -39.68 77.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.398 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.06 85.33 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.998 -0.62 . . . . 10.0 112.382 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -81.15 -12.98 59.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.905 0.383 . . . . 10.0 111.507 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 57.8 m -96.83 2.27 51.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 10.0 111.105 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.41 9.09 62.04 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.736 -0.745 . . . . 10.0 113.32 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -86.28 62.6 7.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.233 0.539 . . . . 10.0 110.39 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.7 p -88.21 154.2 20.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.544 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.9 m -61.76 -15.36 40.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.053 0.454 . . . . 10.0 111.313 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -72.18 -38.21 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.263 0.554 . . . . 10.0 109.966 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.08 -46.11 7.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.554 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.76 92.85 9.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -99.4 154.11 37.45 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.17 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.96 -13.62 38.45 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.87 2.38 . . . . 10.0 112.078 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -110.39 0.69 18.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.217 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.417 ' CB ' ' H ' ' B' ' 112' ' ' ALA . . . -157.9 89.27 2.37 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.586 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.03 141.78 30.22 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.742 2.295 . . . . 10.0 111.568 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.13 116.44 12.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.891 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.34 128.2 35.51 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.555 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 24.3 t -125.42 131.34 72.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.99 122.82 6.42 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.669 -0.777 . . . . 10.0 111.877 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.6 tp -101.53 106.16 17.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 10.0 111.128 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.07 105.51 16.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.458 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.04 117.65 30.04 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -81.7 106.19 13.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.008 0.432 . . . . 10.0 111.573 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.78 128.18 54.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.3 143.2 57.21 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.917 -0.313 . . . . 10.0 111.276 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.29 -3.39 1.85 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.515 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.46 96.17 5.29 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.539 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -77.72 12.65 1.59 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.955 -178.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -62.84 -26.83 68.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.65 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.08 78.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.972 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -70.0 -33.16 71.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.795 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.7 m -74.71 -30.78 61.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.774 -0.648 . . . . 10.0 111.21 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 59.0 mt -84.33 -35.29 10.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.252 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.04 115.36 13.79 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.633 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.93 -14.96 46.97 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.294 2.663 . . . . 10.0 112.51 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.59 -37.65 62.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.026 0.441 . . . . 10.0 110.147 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.37 -35.91 12.16 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.657 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 1.4 m -128.53 144.62 52.78 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.508 -0.314 . . . . 10.0 111.192 -179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.33 145.82 60.88 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.377 2.052 . . . . 10.0 111.083 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.66 128.61 28.92 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.896 2.397 . . . . 10.0 111.624 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -63.01 111.01 1.99 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.918 -0.583 . . . . 10.0 112.174 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 26.4 tp -131.08 131.56 23.25 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.048 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.52 128.65 24.14 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 122.686 2.257 . . . . 10.0 111.733 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -65.41 -37.65 87.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.439 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.1 m -67.22 -20.86 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.318 0.58 . . . . 10.0 110.694 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 74.3 mmm -114.65 52.98 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.027 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 33.1 tttm -126.27 -54.22 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 112.778 0.658 . . . . 10.0 112.778 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.84 63.35 5.84 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.098 1.865 . . . . 10.0 111.858 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -128.92 -173.93 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.813 -0.631 . . . . 10.0 109.609 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.92 178.58 5.24 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.706 -0.397 . . . . 10.0 111.096 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -96.44 139.61 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.723 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -89.13 -156.71 32.01 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.26 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.84 -34.23 16.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.092 0.472 . . . . 10.0 110.553 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m -84.48 162.82 19.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.067 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . 0.417 ' H ' ' CB ' ' B' ' 71' ' ' ALA . . . -70.18 129.08 38.41 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.17 4.45 4.9 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.757 0.661 . . . . 10.0 111.511 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -75.4 141.06 43.3 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -118.19 147.19 43.61 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.091 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -120.32 109.86 15.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.225 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.23 137.41 22.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.122 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.859 179.273 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.235 0.304 0 CA-C-O 120.932 0.396 . . . . 10.0 110.732 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -102.42 111.15 23.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 66.3 mt -92.2 111.37 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -97.37 122.43 48.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.975 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 10.3 p -95.34 171.47 8.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.804 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.8 m -70.19 -7.59 43.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.839 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -91.64 -3.63 56.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.01 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.39 5.66 84.78 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.16 -0.776 . . . . 10.0 111.16 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.11 121.2 26.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -102.52 120.47 40.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.274 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -106.9 123.57 48.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.211 -0.45 . . . . 10.0 111.547 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 17.4 mm -100.7 117.69 46.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.844 -0.798 . . . . 10.0 108.844 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.15 139.68 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.603 -0.147 . . . . 10.0 110.603 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 56.2 tttt -56.44 130.41 44.72 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -53.99 -37.99 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.759 0.281 . . . . 10.0 111.759 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.84 -53.21 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 10.0 110.842 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -66.77 -36.57 82.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.717 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.14 86.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.827 179.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.27 -52.02 66.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.701 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -60.81 -41.43 95.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.731 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -64.74 -39.28 93.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.715 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.76 -10.88 80.64 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.121 -0.561 . . . . 10.0 112.662 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -82.69 -15.26 52.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.508 0.671 . . . . 10.0 109.743 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.1 mt -88.34 159.63 2.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -67.33 86.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.105 0.479 . . . . 10.0 111.435 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.92 165.91 11.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.969 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 96.3 mmm -76.8 41.89 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.92 -28.68 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.263 0.554 . . . . 10.0 109.835 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.89 15.49 22.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.236 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.45 -64.54 3.92 Favored Glycine 0 CA--C 1.52 0.391 0 CA-C-N 115.758 -0.655 . . . . 10.0 113.039 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.72 -154.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.612 2.208 . . . . 10.0 111.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.57 -94.95 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.743 -0.741 . . . . 10.0 112.089 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -113.41 112.01 22.92 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.827 0.346 . . . . 10.0 110.728 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -81.6 100.71 9.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.528 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.07 156.56 39.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.619 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.78 -37.29 73.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.073 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -62.96 -36.53 83.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -71.7 -31.5 66.82 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.206 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -73.75 -32.93 64.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.979 0.419 . . . . 10.0 110.306 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -75.59 -37.73 59.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -132.55 88.31 2.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.731 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.5 117.71 26.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.374 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -95.73 110.87 22.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.244 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -94.66 115.58 27.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.895 0.379 . . . . 10.0 111.354 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -99.07 136.83 38.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.395 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 70.15 27.48 4.22 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.893 0.746 . . . . 10.0 111.703 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 78.4 mt -132.89 109.92 13.05 Favored Pre-proline 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.307 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.89 152.22 83.01 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.912 2.408 . . . . 10.0 112.575 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.3 p -63.99 -34.44 78.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.946 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.17 -57.7 10.15 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -179.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.8 m -64.77 -35.24 74.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.427 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.5 tp -63.98 -37.51 87.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.61 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 35.5 m -59.71 -40.67 88.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.584 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -68.49 -35.94 78.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.337 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 78.4 t -62.97 -47.98 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.27 -40.95 92.19 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.553 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.6 mtm -65.55 -41.31 93.13 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -65.43 -40.83 93.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.603 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -62.66 -46.65 87.23 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 35.6 m -58.4 -44.62 89.05 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.329 0.585 . . . . 10.0 110.146 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -64.85 -41.84 95.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.36 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -63.26 -38.71 92.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.247 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.75 -47.54 92.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -71.65 -40.81 69.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.361 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.64 -47.58 83.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.981 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.59 32.39 0.79 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.968 0.413 . . . . 10.0 110.952 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -138.83 -56.01 0.61 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.649 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.04 -35.83 0.62 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.713 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 1.4 m -80.67 38.76 0.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.951 0.405 . . . . 10.0 111.892 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.01 -17.03 32.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.45 0.643 . . . . 10.0 109.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -78.46 -14.78 59.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.489 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 40.1 pt -99.46 166.85 12.15 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.377 -0.601 . . . . 10.0 109.377 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -67.79 166.61 23.77 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.201 1.934 . . . . 10.0 113.247 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -74.37 171.75 13.13 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.417 -0.957 . . . . 10.0 108.417 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -52.3 128.49 40.8 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 110.394 -0.224 . . . . 10.0 110.394 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.01 129.55 35.09 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.811 2.34 . . . . 10.0 112.249 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 40.1 pt -84.05 40.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.307 0.575 . . . . 10.0 111.437 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.69 -57.3 0.36 Allowed Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.736 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -70.17 117.0 4.86 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.789 1.66 . . . . 10.0 110.778 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -73.98 3.73 6.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 43.0 mm -83.07 82.11 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.398 0.618 . . . . 10.0 110.026 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.65 -37.36 0.12 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.428 -0.805 . . . . 10.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 20.1 tp -66.2 -25.42 66.92 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -63.39 -32.93 74.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.715 -1.129 . . . . 10.0 109.508 178.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.42 -34.2 48.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.759 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.2 -27.86 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.067 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 46.8 ttp -59.21 -25.9 64.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.548 -0.751 . . . . 10.0 111.752 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.19 -29.23 70.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.993 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.96 -65.35 0.22 Allowed 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.472 0.916 . . . . 10.0 113.472 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -80.18 33.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.896 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 112.744 -0.142 . . . . 10.0 112.744 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -56.41 22.57 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tp -57.6 -34.84 69.68 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -61.41 -37.19 82.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.045 0.45 . . . . 10.0 111.058 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -84.87 -41.95 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.52 -39.69 94.36 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.252 0.464 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.18 94.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.729 0.299 . . . . 10.0 111.011 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.83 -30.53 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.237 0.542 . . . . 10.0 110.475 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.07 -3.24 57.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.744 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.19 -41.0 5.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.426 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.61 133.14 5.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.834 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.0 mt -99.69 100.41 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -108.89 101.66 45.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 10.0 111.283 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.55 71.36 4.68 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.308 2.672 . . . . 10.0 110.717 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 mttm -128.22 177.92 6.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.064 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -83.89 144.57 29.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.093 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.13 105.21 18.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.733 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.13 140.12 23.19 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -40.36 132.53 2.31 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.47 2.78 . . . . 10.0 112.772 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.11 141.36 98.03 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.282 2.655 . . . . 10.0 112.876 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.05 135.15 55.17 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.251 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.44 -7.5 21.39 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 122.862 2.375 . . . . 10.0 112.812 -178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -38.89 80.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.394 -0.367 . . . . 10.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 t -122.29 -117.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.23 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -166.75 49.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.992 0.425 . . . . 10.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -148.52 150.61 33.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.803 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.47 156.03 37.38 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.769 0.319 . . . . 10.0 111.002 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.91 170.64 8.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.62 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -119.16 125.72 49.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -166.76 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.84 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.73 -67.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.825 -0.435 . . . . 10.0 109.825 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.672 -0.68 . . . . 10.0 110.293 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.863 0.363 . . . . 10.0 110.579 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -81.68 143.08 32.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.039 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -133.22 112.26 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.868 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -97.92 110.15 22.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.167 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.18 153.71 38.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.937 0.399 . . . . 10.0 111.431 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 36.8 mtm -123.87 110.89 15.42 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.451 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.1 mm -81.61 113.23 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.32 110.31 21.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.434 0.635 . . . . 10.0 112.635 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.5 ttp85 -103.36 68.63 0.97 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 107.034 -1.469 . . . . 10.0 107.034 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 66.16 -88.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.909 -1.041 . . . . 10.0 111.144 -178.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -96.8 -21.77 17.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.844 0.354 . . . . 10.0 111.455 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -90.1 120.3 31.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.495 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.49 125.13 48.16 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.989 -0.374 . . . . 10.0 109.989 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 63.8 mt -118.63 118.37 57.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.715 0.293 . . . . 10.0 111.6 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -80.73 115.34 20.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.6 m -112.08 112.32 23.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.076 0.465 . . . . 10.0 112.248 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.62 100.75 13.43 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.639 -1.245 . . . . 10.0 107.639 177.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -120.65 -173.44 2.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.879 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 mmtt -125.88 160.57 29.55 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.03 -25.44 66.91 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.055 0.455 . . . . 10.0 111.203 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -2.18 49.63 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.9 m -86.74 141.28 29.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.685 0.279 . . . . 10.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 16.0 p -87.91 159.58 18.3 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.544 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 t -63.31 -35.22 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.919 0.39 . . . . 10.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.91 -35.94 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.58 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -63.95 -34.62 78.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.048 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.4 mt -63.73 -44.98 91.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.27 -34.26 77.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.125 179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -65.64 -39.44 91.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.146 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.7 mt -66.2 -42.73 91.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -63.14 -37.91 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.445 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.67 -33.67 76.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.499 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.84 -26.57 66.69 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.495 -0.86 . . . . 10.0 112.458 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.4 mt -91.37 -57.49 4.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 70.0 mt -83.45 -15.48 49.44 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.384 0.512 . . . . 10.0 112.384 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.8 mttt 64.16 31.72 13.07 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.147 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -112.91 132.18 22.44 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.142 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 125.85 10.54 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.695 2.93 . . . . 10.0 113.436 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.23 -20.39 43.25 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.938 2.425 . . . . 10.0 112.102 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.33 -31.76 73.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.287 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -98.97 10.86 40.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.036 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -93.67 128.37 39.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.859 0.362 . . . . 10.0 110.825 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 70.0 mmt-85 -118.72 111.2 18.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.031 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -93.28 121.14 34.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -114.78 122.12 45.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.13 0.49 . . . . 10.0 111.74 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -118.19 123.52 45.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.401 -0.818 . . . . 10.0 108.833 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 57.4 43.19 23.57 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.443 0.465 . . . . 10.0 111.099 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 69.33 5.92 5.4 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -119.19 147.03 44.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.736 0.303 . . . . 10.0 111.549 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.23 132.47 43.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.521 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.8 mt -78.41 171.07 15.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -83.22 -157.53 0.24 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.603 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.62 -50.65 0.46 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.097 0.475 . . . . 10.0 110.012 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.18 -21.53 54.69 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.842 -0.694 . . . . 10.0 112.845 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -73.97 157.41 36.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.949 0.404 . . . . 10.0 111.013 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 25.6 p -90.64 169.25 11.16 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.465 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 79.2 mt -62.07 -35.59 79.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.598 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.04 -22.95 65.44 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.387 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -94.75 -6.53 42.84 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.756 0.313 . . . . 10.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 44.5 m -107.84 23.05 15.06 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.046 0.387 . . . . 10.0 112.046 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.94 28.09 71.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.961 -0.638 . . . . 10.0 113.519 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -107.26 99.41 8.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.904 0.383 . . . . 10.0 110.757 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -124.31 178.05 5.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 6.1 m -75.59 4.97 6.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.502 . . . . 10.0 111.154 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -97.31 -38.15 9.77 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.46 -39.79 18.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.197 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.77 107.52 17.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.776 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -118.91 161.74 34.77 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.103 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.69 -34.73 75.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.163 2.576 . . . . 10.0 113.264 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.33 11.37 27.21 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.233 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -151.01 77.09 7.75 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.674 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.24 132.2 13.6 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.748 2.299 . . . . 10.0 111.617 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.18 122.79 18.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.546 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -78.46 126.15 30.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.478 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 42.3 t -121.77 130.33 74.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.14 135.28 13.52 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.653 -0.784 . . . . 10.0 111.84 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.3 tp -116.36 104.12 11.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.915 0.388 . . . . 10.0 111.333 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -97.95 119.55 36.77 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -98.96 123.16 43.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.286 -0.264 . . . . 10.0 110.286 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -75.03 78.09 2.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.279 0.561 . . . . 10.0 110.754 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -85.96 136.03 33.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.534 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -67.88 128.47 36.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.988 -0.551 . . . . 10.0 112.2 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.27 19.27 9.97 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.677 -0.692 . . . . 10.0 112.398 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.1 m -111.86 112.81 24.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.829 0.347 . . . . 10.0 110.529 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -77.44 -8.51 57.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.752 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -60.95 -28.63 69.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.367 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.19 -40.96 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.211 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.94 -21.31 60.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.371 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 30.5 m -83.83 -23.83 31.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.407 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 mt -90.53 -33.79 6.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.427 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.19 113.53 11.7 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.66 -2.67 11.73 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.899 2.4 . . . . 10.0 112.182 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -80.53 -45.72 16.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.353 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -88.64 -28.96 20.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.811 -0.632 . . . . 10.0 111.542 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 2.3 m -132.29 136.55 28.26 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.647 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.1 151.24 79.94 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 122.553 2.169 . . . . 10.0 111.539 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.35 127.03 24.2 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.985 2.457 . . . . 10.0 112.12 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.58 120.85 14.13 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.773 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 23.5 tp -135.69 132.48 19.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.341 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.22 127.7 25.87 Favored 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.635 2.223 . . . . 10.0 111.844 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.85 -36.47 83.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.958 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.3 m -73.15 -21.76 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.132 0.491 . . . . 10.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 74.7 mmm -111.42 62.18 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -131.27 -55.08 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.851 0.685 . . . . 10.0 112.851 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -74.74 62.42 5.62 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.484 2.123 . . . . 10.0 111.793 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -130.98 -178.24 4.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.915 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -90.35 177.69 6.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.873 0.368 . . . . 10.0 111.82 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 12.7 m -107.36 132.73 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.675 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.15 -150.59 13.05 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.984 -0.627 . . . . 10.0 113.133 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.02 -41.76 11.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.002 0.429 . . . . 10.0 111.295 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 19.5 m -79.91 166.12 21.97 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.684 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -73.55 127.9 34.01 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.0 t30 74.97 13.96 3.26 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.613 0.571 . . . . 10.0 110.954 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -85.84 121.61 28.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -106.4 146.06 30.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.081 0.467 . . . . 10.0 111.545 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.1 105.4 11.36 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.238 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.34 127.23 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.537 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.091 179.471 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.918 0.389 . . . . 10.0 110.729 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -109.12 119.07 38.42 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.18 117.84 31.55 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mp -103.63 113.2 39.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.791 0.329 . . . . 10.0 110.222 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.8 p -83.26 176.24 9.3 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.875 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.1 m -72.04 -7.06 46.66 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -93.82 -2.38 53.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.045 0.45 . . . . 10.0 109.832 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.71 9.7 80.65 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 10.0 111.867 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.12 123.09 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.676 0.274 . . . . 10.0 110.627 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -94.87 114.48 26.35 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.686 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -104.07 107.08 17.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mm -89.4 114.89 28.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.627 178.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.1 t -103.63 128.23 57.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.424 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -60.06 134.13 56.75 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -57.52 -28.81 63.81 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -55.51 -38.16 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.913 0.387 . . . . 10.0 111.139 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -95.09 -26.38 16.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.304 0.573 . . . . 10.0 110.148 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -33.51 75.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.632 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 75.2 mt -58.39 -51.5 69.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.229 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 24.0 m -65.47 -41.26 93.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.432 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 24.3 m -58.39 -41.68 85.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.857 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.32 -15.36 81.21 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.982 -0.628 . . . . 10.0 112.575 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 38.7 m -82.13 -31.86 30.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.008 0.432 . . . . 10.0 110.166 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -69.87 158.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.205 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -71.4 87.03 0.85 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.078 0.466 . . . . 10.0 110.988 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -107.24 166.01 10.95 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.167 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.0 mmm -79.03 42.91 0.49 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.937 0.347 . . . . 10.0 111.937 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.34 -18.18 60.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.221 0.534 . . . . 10.0 110.427 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 15.9 m -101.05 14.59 31.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.85 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.97 -61.18 5.42 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.105 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.48 161.06 21.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.28 1.987 . . . . 10.0 111.968 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.71 23.82 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.943 -0.571 . . . . 10.0 112.621 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -127.27 113.56 16.46 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.939 0.4 . . . . 10.0 111.398 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -91.27 94.42 9.53 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.8 172.28 9.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -63.5 -14.93 55.94 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.593 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -55.78 22.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.775 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -67.24 -31.64 72.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.939 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -62.57 -24.26 67.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.034 0.445 . . . . 10.0 111.034 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.37 -53.43 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.278 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -128.09 105.26 8.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.841 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 t -84.22 121.59 36.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.796 0.331 . . . . 10.0 110.737 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -90.39 103.82 16.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.71 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -98.19 112.88 24.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.182 0.515 . . . . 10.0 111.533 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -106.12 144.21 33.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 67.69 22.1 9.08 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.752 0.657 . . . . 10.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.2 mt -128.36 107.97 19.34 Favored Pre-proline 0 C--O 1.237 0.396 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.664 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -63.46 148.14 92.81 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.966 2.444 . . . . 10.0 111.837 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.1 p -59.76 -39.62 85.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.511 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -58.56 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 113.006 0.743 . . . . 10.0 113.006 -179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 28.3 m -62.71 -36.67 76.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 10.0 111.324 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 27.0 tp -64.09 -36.06 82.78 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.691 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 19.9 m -63.0 -40.6 98.26 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.292 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -66.79 -37.27 84.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.395 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.26 -47.26 93.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.779 178.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -61.24 -39.2 89.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.838 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.0 mtm -65.01 -42.24 94.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.045 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -67.11 -39.79 86.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.416 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -60.89 -48.81 80.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.163 -0.472 . . . . 10.0 109.899 178.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 25.7 m -59.16 -40.92 87.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.214 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -64.01 -43.08 96.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.455 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -66.61 -34.22 77.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.166 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 54.1 t -62.17 -46.4 96.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -74.57 -38.05 62.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.804 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -58.59 -52.17 66.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.677 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -83.76 42.01 0.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.218 0.532 . . . . 10.0 110.539 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -152.77 -62.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.583 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.62 -36.02 1.45 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.909 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 20.4 m -82.5 43.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 111.932 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 -5.01 48.91 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.603 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -92.0 -7.8 47.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.029 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 pt -102.38 161.9 21.89 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.467 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -65.67 164.48 26.44 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.749 2.3 . . . . 10.0 112.534 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.4 168.25 11.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.273 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -51.19 131.32 32.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 122.314 0.246 . . . . 10.0 110.971 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.5 124.45 15.18 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.131 2.554 . . . . 10.0 112.313 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 15.3 pt -83.64 45.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 10.0 111.231 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.22 -53.91 0.19 Allowed Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.956 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.72 98.87 0.71 Allowed 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.062 1.841 . . . . 10.0 110.725 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -68.69 3.61 1.81 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.042 0.756 . . . . 10.0 113.042 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 20.2 mm -77.66 -2.94 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.522 0.677 . . . . 10.0 110.625 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.5 -28.94 67.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.622 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 tp -77.51 -22.58 50.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.861 0.362 . . . . 10.0 110.846 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -64.79 -26.14 68.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 10.0 109.651 178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 mt -75.91 -27.31 57.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.703 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.65 -20.99 64.48 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.437 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.6 -23.62 67.46 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.915 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.98 -44.35 87.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.347 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.82 -58.57 0.39 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -78.59 19.64 0.48 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.999 0.37 . . . . 10.0 111.999 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.98 -0.533 . . . . 10.0 109.638 179.864 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 111.801 -0.52 . . . . 10.0 111.801 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.82 -59.72 4.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.651 0.612 . . . . 10.0 112.651 -179.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 24.5 tp -65.66 -37.38 86.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.461 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -58.25 -24.5 59.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.146 0.498 . . . . 10.0 111.101 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -98.85 -46.78 5.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.104 0.478 . . . . 10.0 110.496 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.43 -34.83 78.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.06 92.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.727 0.299 . . . . 10.0 111.324 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.3 tp -68.14 -28.85 67.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.522 . . . . 10.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.56 -10.29 59.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.283 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.3 -36.04 10.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.21 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tp -151.1 121.72 7.46 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.265 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 mp -86.63 92.62 3.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.68 -0.859 . . . . 10.0 108.68 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -106.28 105.9 55.54 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.006 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -98.0 64.68 0.09 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.386 2.724 . . . . 10.0 110.802 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -124.8 170.84 10.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.018 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -77.44 145.49 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.529 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mm -116.28 99.61 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.219 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -104.92 142.05 23.84 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 107.662 -1.236 . . . . 10.0 107.662 178.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -36.1 130.92 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.586 2.858 . . . . 10.0 112.912 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.93 137.66 61.37 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.568 2.845 . . . . 10.0 113.165 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 125.08 83.31 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.252 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.95 -15.58 48.56 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.08 2.52 . . . . 10.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.19 -35.08 79.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.464 -0.335 . . . . 10.0 111.181 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -130.0 -127.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 109.996 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -155.22 52.29 0.61 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.136 0.493 . . . . 10.0 111.02 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -149.17 151.36 34.2 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -74.74 148.47 40.43 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.124 -0.324 . . . . 10.0 110.124 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.92 155.17 21.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.369 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -107.59 110.82 22.8 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -162.43 -77.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.55 -69.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.731 -1.128 . . . . 10.0 109.397 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mmm . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.758 0.313 . . . . 10.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.3 141.16 35.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.119 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 79.6 t -117.06 116.08 50.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.096 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -104.08 114.75 29.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.346 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -134.27 158.33 44.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.878 0.37 . . . . 10.0 111.445 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 60.8 mtm -125.94 117.03 22.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.418 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.4 mm -87.49 112.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -108.92 109.3 20.34 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -99.81 73.77 1.8 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.388 -1.338 . . . . 10.0 107.388 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 66.63 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.362 -0.835 . . . . 10.0 111.18 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -108.91 -24.55 11.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.947 0.404 . . . . 10.0 110.905 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.4 m -86.06 107.77 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.89 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -110.66 123.47 50.07 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.423 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 20.5 mt -118.72 122.19 68.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.758 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -79.84 121.68 25.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 2.2 m -112.11 118.36 35.17 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 10.0 111.607 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -104.09 93.58 4.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.155 -1.054 . . . . 10.0 108.155 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.2 -167.95 1.36 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.479 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -127.58 166.37 18.16 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -62.61 -23.12 66.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.892 0.377 . . . . 10.0 111.6 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.98 -9.58 59.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.716 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.7 m -81.19 142.81 32.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.69 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 57.7 p -92.21 169.6 10.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.617 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.4 t -69.7 -34.9 63.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.089 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -63.57 -35.05 79.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.349 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -62.17 -36.14 80.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.764 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -45.36 94.86 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.469 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 97.5 mttt -60.46 -40.03 89.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.053 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -62.66 -41.08 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.572 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -66.79 -47.8 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.271 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -61.6 -36.53 73.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 10.0 110.53 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -36.41 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.029 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.98 -5.88 89.37 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 121.063 -0.589 . . . . 10.0 112.791 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 69.4 mt -107.48 -50.2 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.792 0.33 . . . . 10.0 110.81 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 30.5 mt -87.14 -9.58 54.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 10.0 111.767 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.03 50.15 12.58 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.503 0.502 . . . . 10.0 111.474 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.58 142.25 31.11 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.512 -179.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.85 128.83 16.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.498 2.799 . . . . 10.0 113.102 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.86 -24.94 20.56 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 123.027 2.485 . . . . 10.0 112.743 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 t0 -68.99 -23.05 64.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.933 0.397 . . . . 10.0 111.038 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -90.7 -2.99 57.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.592 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -88.85 135.8 33.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.955 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 60.3 mmt-85 -125.46 110.81 14.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.217 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 90.4 mt -91.79 120.79 32.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.881 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -114.36 118.69 34.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.081 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -123.06 130.56 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.901 -0.777 . . . . 10.0 108.901 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 61.23 33.76 19.02 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.068 0.461 . . . . 10.0 110.242 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 65.55 21.89 11.76 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.477 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -130.78 149.15 52.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.781 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -78.13 131.42 37.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.733 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -80.15 150.76 30.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.504 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.71 124.37 39.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.817 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.469 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 1.1 m-20 -56.22 -33.6 65.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.41 -22.49 67.4 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.821 -0.704 . . . . 10.0 113.81 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.11 157.77 23.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.245 0.545 . . . . 10.0 111.796 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 26.3 p -94.19 167.49 11.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.467 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.08 -43.16 91.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.764 0.316 . . . . 10.0 111.724 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.52 -35.44 72.79 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.952 -0.642 . . . . 10.0 113.061 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -79.4 -17.83 53.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.809 0.337 . . . . 10.0 111.298 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.3 m -90.47 6.57 42.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.649 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.22 16.64 53.12 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.565 -0.826 . . . . 10.0 112.716 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -92.04 90.31 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.837 0.351 . . . . 10.0 110.145 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 39.4 p -116.02 176.83 4.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.99 -0.13 6.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 10.0 111.592 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -95.0 -51.14 4.79 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.861 0.362 . . . . 10.0 110.241 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.99 -25.46 43.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.931 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -119.25 95.88 4.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.135 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -119.0 156.79 51.85 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.767 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.32 -15.14 48.61 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.419 2.079 . . . . 10.0 111.228 179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.39 -7.48 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.605 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -160.84 92.08 1.56 Allowed Pre-proline 0 C--O 1.235 0.297 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.675 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -80.56 130.28 7.79 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.904 2.403 . . . . 10.0 111.376 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.55 127.29 30.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.626 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m -85.78 127.18 34.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.056 0.455 . . . . 10.0 111.617 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.2 t -121.74 133.24 68.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.382 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.04 137.64 17.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.775 -0.726 . . . . 10.0 111.577 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 tp -116.89 109.63 17.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.071 0.463 . . . . 10.0 111.887 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.69 151.7 20.44 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -128.37 123.37 33.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.746 0.307 . . . . 10.0 110.808 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -74.64 89.18 2.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.177 0.513 . . . . 10.0 111.191 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -119.78 129.87 54.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.588 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.04 137.62 49.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.038 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 69.5 13.21 8.33 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.596 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.6 m -116.92 96.21 5.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.621 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.23 -8.83 57.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.708 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -60.11 -31.56 70.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.451 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.32 88.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.161 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.43 -21.6 64.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 16.2 m -84.04 -18.14 38.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.111 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.48 -29.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.856 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.58 116.06 23.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.217 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.79 -14.36 44.24 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.004 2.469 . . . . 10.0 111.953 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -91.86 -15.61 27.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 10.9 m -103.17 -30.94 10.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.885 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 69.2 m -148.68 147.1 23.74 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.44 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.6 138.78 50.88 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.311 2.008 . . . . 10.0 111.282 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.92 125.42 8.25 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.217 2.611 . . . . 10.0 111.75 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -56.09 113.46 1.54 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.634 -0.712 . . . . 10.0 111.873 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 23.2 tp -143.87 125.41 8.16 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.419 -0.809 . . . . 10.0 109.279 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -64.83 123.72 12.07 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.8 2.333 . . . . 10.0 111.997 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -63.21 -30.28 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.176 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -66.77 -14.01 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.297 0.57 . . . . 10.0 110.116 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 78.4 mmm -123.08 34.8 5.03 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.3 tttm -105.6 -49.1 0.12 Allowed Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 113.029 0.752 . . . . 10.0 113.029 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -73.67 63.02 4.71 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.0 1.8 . . . . 10.0 112.688 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -133.6 150.31 51.61 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.74 148.98 45.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.584 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.8 m -76.17 141.52 41.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.979 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -84.88 -144.15 6.66 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.52 -37.04 12.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.119 0.485 . . . . 10.0 110.658 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 66.4 m -80.65 161.94 24.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.671 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.83 126.68 28.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.016 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 66.06 14.71 9.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.064 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -76.43 136.2 39.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.799 0.333 . . . . 10.0 110.176 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -115.37 144.41 43.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.812 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -130.33 113.15 14.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.007 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.39 126.33 36.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.44 -0.346 . . . . 10.0 110.392 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.474 -0.33 . . . . 10.0 111.534 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.065 0.46 . . . . 10.0 111.321 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -118.07 115.93 25.84 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.766 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.6 mt -87.8 124.33 33.51 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.774 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt -107.61 113.07 42.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -83.82 166.26 18.1 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.653 -0.249 . . . . 10.0 111.019 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -68.69 -10.52 56.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.493 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -84.48 -11.84 55.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.157 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.98 28.46 20.83 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.147 -0.781 . . . . 10.0 111.147 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -106.46 133.09 51.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.171 -0.307 . . . . 10.0 110.171 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -98.2 129.82 44.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.354 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -123.23 101.12 7.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.68 0.276 . . . . 10.0 110.634 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -94.06 125.62 46.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 4.5 t -107.64 148.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.904 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttt -59.56 138.18 57.78 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.119 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -51.56 -43.73 62.49 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.277 0.473 . . . . 10.0 112.277 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.84 -52.17 66.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.396 . . . . 10.0 111.51 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -65.79 -41.29 92.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.775 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.87 96.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.398 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 65.7 mt -62.6 -48.24 80.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.71 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 8.7 m -60.74 -41.16 94.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 36.4 m -67.59 -31.72 71.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.429 . . . . 10.0 110.561 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.79 -9.84 83.2 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.932 -0.651 . . . . 10.0 112.151 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -84.03 -17.97 38.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.055 0.455 . . . . 10.0 110.109 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.8 mt -80.3 157.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.674 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -73.34 78.1 1.36 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.201 0.524 . . . . 10.0 110.524 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.75 9.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.458 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 92.2 mmm -78.34 31.41 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.249 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mp -68.59 -26.12 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.158 0.504 . . . . 10.0 110.503 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 7.6 m -95.71 15.73 19.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.199 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.0 -61.31 3.8 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.378 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.82 166.61 15.6 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.713 2.275 . . . . 10.0 111.464 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.03 -66.64 2.71 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.31 -0.471 . . . . 10.0 113.551 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -126.05 120.9 31.45 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 122.39 -0.476 . . . . 10.0 111.415 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -95.65 90.96 5.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.35 166.6 22.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.702 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -63.8 -33.97 76.86 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -63.53 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.759 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -72.69 -24.0 60.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.432 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -80.3 -19.26 47.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.26 0.552 . . . . 10.0 109.929 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -94.09 -59.95 1.85 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.979 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -105.83 89.18 3.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.087 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 t -84.89 94.66 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.109 -178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -82.18 119.12 23.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.049 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -104.56 124.16 48.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.545 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -105.08 140.5 38.16 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.934 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 69.52 19.78 7.37 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.878 0.736 . . . . 10.0 111.011 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -127.04 107.5 21.92 Favored Pre-proline 0 C--O 1.236 0.389 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.98 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -64.97 158.75 49.82 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 123.269 2.646 . . . . 10.0 112.13 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -67.37 -41.52 84.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.266 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -57.41 8.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.518 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 32.4 m -65.56 -35.25 74.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.674 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -66.66 -34.69 78.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -60.16 -42.92 95.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.73 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 46.8 tttp -65.9 -35.18 79.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.458 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -44.57 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.736 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 54.8 m -61.18 -42.65 98.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.687 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.4 mtm -66.63 -38.91 87.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.726 179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -62.09 -43.84 97.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.587 179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -65.13 -43.35 92.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.262 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 75.3 m -57.85 -43.78 86.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.415 0.626 . . . . 10.0 109.584 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -67.07 -42.8 84.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.133 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -59.97 -39.12 84.53 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.232 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 56.0 t -59.4 -50.08 81.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.004 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.1 mmt180 -71.96 -37.24 69.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.653 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.03 -42.36 90.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.965 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.6 13.65 15.36 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.758 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -117.2 -56.34 2.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.331 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.12 -20.44 0.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 13.7 m -84.15 27.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.127 0.489 . . . . 10.0 111.512 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 -11.2 59.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.278 0.561 . . . . 10.0 110.128 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -77.42 -22.63 51.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.326 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 37.0 pt -100.37 165.88 13.63 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.031 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.11 171.2 16.38 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.306 2.004 . . . . 10.0 113.241 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.51 173.68 7.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.147 -0.933 . . . . 10.0 108.904 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -54.01 130.26 58.27 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.71 131.79 38.95 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.135 2.557 . . . . 10.0 112.914 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 16.7 pt -84.14 37.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.915 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -90.18 -54.58 0.29 Allowed Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.55 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -65.49 116.94 4.19 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.758 1.639 . . . . 10.0 111.681 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -69.58 -2.39 11.36 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.44 94.9 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.221 0.534 . . . . 10.0 110.452 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.51 -42.46 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.619 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.43 -24.85 64.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -63.27 -35.64 81.01 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.887 -1.051 . . . . 10.0 108.946 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 44.1 mt -78.97 -34.36 44.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.264 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 5.4 tt -64.46 -30.23 71.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.221 -0.9 . . . . 10.0 110.034 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 29.0 ttp -62.53 -18.16 61.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.44 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.56 83.06 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.593 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.94 -51.67 0.53 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.453 0.908 . . . . 10.0 113.453 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -78.81 13.54 1.66 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.878 0.371 . . . . 10.0 111.49 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.876 0 CA-C-O 118.786 -0.626 . . . . 10.0 109.435 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 CA-C-O 120.196 -0.224 . . . . 10.0 112.916 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -67.37 0.4 Allowed 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.871 0.323 . . . . 10.0 111.871 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.87 -34.79 78.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 10.0 110.392 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -52.45 -34.97 51.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.694 -0.685 . . . . 10.0 111.185 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -100.32 -40.77 7.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.566 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.18 -39.86 94.88 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.064 0.765 . . . . 10.0 113.064 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.31 -30.64 69.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.628 0.252 . . . . 10.0 111.382 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.4 -32.58 73.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.151 0.5 . . . . 10.0 110.192 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.65 56.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.553 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.04 -26.63 15.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -164.93 118.99 1.29 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.644 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.3 mt -86.02 97.03 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -113.29 97.01 41.65 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.186 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -88.22 59.14 2.88 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.854 2.369 . . . . 10.0 111.631 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -111.66 177.31 4.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.786 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -81.06 151.97 28.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.719 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mm -116.05 110.79 32.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.143 0.497 . . . . 10.0 111.351 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.87 137.38 30.43 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 178.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -32.7 137.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 124.27 3.313 . . . . 10.0 114.297 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.87 131.13 40.17 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.056 2.504 . . . . 10.0 112.217 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.72 123.21 89.08 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.643 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 -9.2 21.76 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.995 2.463 . . . . 10.0 111.876 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -31.63 72.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.103 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.0 t -134.78 -100.06 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.609 179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.1 ptp180 176.81 53.66 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.191 0.597 . . . . 10.0 110.594 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -149.52 149.19 30.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.45 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -72.4 159.6 33.72 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.931 0.396 . . . . 10.0 110.861 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.83 179.47 4.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.874 -179.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -124.6 130.2 51.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.84 0.352 . . . . 10.0 111.129 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -168.37 -74.08 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.632 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.412 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.07 -56.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.851 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.621 -0.704 . . . . 10.0 110.261 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.7 tmm? . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 120.976 0.417 . . . . 10.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.0 143.29 31.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.346 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -127.49 118.31 49.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 120.992 0.425 . . . . 10.0 110.264 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -105.37 113.09 26.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.45 179.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.38 156.99 42.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.809 0.338 . . . . 10.0 111.354 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 64.6 mtm -125.21 108.37 11.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.529 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.4 mm -81.33 104.34 9.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.419 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -100.49 102.04 13.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 29.7 ttp85 -89.25 65.8 7.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-160 68.73 -77.94 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.145 -0.934 . . . . 10.0 110.645 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -108.54 -15.81 14.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.986 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -97.56 99.35 10.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.243 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -98.17 113.68 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.738 0.304 . . . . 10.0 110.561 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 51.5 mt -108.36 119.2 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.909 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -80.66 124.24 28.84 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.815 -0.439 . . . . 10.0 109.815 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.2 m -117.93 122.28 42.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.041 0.448 . . . . 10.0 112.093 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -104.47 99.25 8.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.818 -1.178 . . . . 10.0 107.818 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.55 -167.89 1.6 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.844 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -123.45 160.39 27.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.22 -26.72 67.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.956 0.408 . . . . 10.0 111.954 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.89 -10.75 59.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.983 -0.553 . . . . 10.0 112.062 -179.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 17.8 m -72.86 143.16 47.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -90.37 157.91 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.722 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -60.72 -36.75 73.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 10.0 111.165 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.9 -30.59 70.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.833 179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.18 -36.76 85.22 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.27 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.3 mt -61.23 -43.08 99.46 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.534 -0.543 . . . . 10.0 109.534 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.495 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 97.1 mttt -61.71 -38.52 88.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.168 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 61.9 mtp180 -65.87 -39.49 90.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.818 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 99.0 mt -65.96 -46.31 88.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.58 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 70.0 t -62.15 -38.1 80.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.753 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.54 -37.1 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.08 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.02 -4.35 77.53 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 120.972 -0.633 . . . . 10.0 112.895 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 84.4 mt -112.68 -54.03 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.725 0.298 . . . . 10.0 111.23 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.9 mt -82.39 -14.66 54.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.239 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 63.4 mttt 58.0 48.68 12.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.757 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -137.27 139.98 29.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.328 -0.851 . . . . 10.0 110.072 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -43.85 123.87 4.24 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.923 3.082 . . . . 10.0 113.665 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.4 -16.53 31.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.924 2.416 . . . . 10.0 111.848 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.69 -38.48 85.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.216 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -96.61 14.18 25.69 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.89 127.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -112.95 108.23 17.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.567 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.3 mt -90.71 112.37 24.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.087 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -108.06 117.38 34.0 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -132.23 138.33 47.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.301 -1.0 . . . . 10.0 108.301 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 63.39 27.98 15.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.446 0.466 . . . . 10.0 109.871 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 67.12 17.24 10.38 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.464 -0.789 . . . . 10.0 111.613 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -129.49 166.11 20.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.9 tp -89.91 130.54 36.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.577 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 82.9 mt -72.71 158.2 36.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.226 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -100.54 127.15 46.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.956 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.495 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 37.3 m-20 -66.24 -28.2 68.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.597 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.1 8.18 79.94 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.109 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.79 159.71 21.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.865 0.364 . . . . 10.0 110.817 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 28.2 p -92.06 170.47 9.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.72 -42.45 99.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.79 -33.8 69.06 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.165 -0.54 . . . . 10.0 112.589 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -80.03 -13.64 59.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.678 0.275 . . . . 10.0 111.572 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 59.9 m -99.62 16.27 23.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.949 0.404 . . . . 10.0 111.633 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.17 11.85 77.62 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.728 -0.748 . . . . 10.0 113.199 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -86.84 96.86 10.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 117.061 0.431 . . . . 10.0 110.186 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 156.83 31.89 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 50.7 m -60.86 -22.28 64.1 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.183 0.438 . . . . 10.0 112.183 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -76.43 -37.36 57.14 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.812 0.301 . . . . 10.0 111.812 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -39.32 18.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.196 0.522 . . . . 10.0 109.674 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.56 82.1 1.99 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.283 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -89.67 157.76 46.22 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.029 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.28 -21.24 71.17 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.609 2.206 . . . . 10.0 111.819 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 4.05 23.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.794 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -155.83 80.23 4.05 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.613 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -74.7 144.83 31.92 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.889 2.392 . . . . 10.0 111.99 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 120.74 19.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.816 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.46 120.93 21.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.465 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 42.0 t -118.77 133.84 64.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.19 137.64 14.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.626 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.81 107.93 14.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.969 0.414 . . . . 10.0 111.578 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -103.55 138.83 39.7 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.183 -0.673 . . . . 10.0 109.183 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -114.79 121.75 44.25 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -74.57 82.87 2.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 10.0 111.849 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.21 122.32 43.97 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -66.01 145.88 55.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.338 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.93 24.79 14.74 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.875 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.3 m -132.09 112.34 12.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.207 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -69.82 -19.1 63.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.052 0.453 . . . . 10.0 111.198 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -54.64 -33.2 60.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.217 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.55 -30.26 69.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.769 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 14.0 mt -92.18 -9.92 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.316 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 43.0 m -87.23 -35.62 18.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.917 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mt -89.54 14.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.234 0.54 . . . . 10.0 110.825 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.94 103.85 46.41 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -67.97 -3.86 11.36 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.338 2.692 . . . . 10.0 112.054 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -75.65 -27.62 58.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.998 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 68.7 m -124.31 -35.56 2.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.239 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 58.8 m -103.42 151.54 38.65 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.419 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.49 157.84 32.56 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.553 2.169 . . . . 10.0 111.441 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 132.87 31.43 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.268 1.979 . . . . 10.0 111.4 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -68.67 108.97 3.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.069 0.462 . . . . 10.0 111.424 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 19.2 tp -138.57 125.43 13.05 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.35 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.75 135.01 57.25 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.81 2.34 . . . . 10.0 112.698 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.34 -38.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.971 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 m -68.24 -18.2 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.236 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 93.8 mmm -115.45 51.03 0.95 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.468 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -119.38 -53.87 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.77 67.62 7.32 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.499 2.133 . . . . 10.0 111.903 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -133.4 162.15 32.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.517 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -79.91 178.03 8.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.021 0.438 . . . . 10.0 111.356 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.88 131.13 43.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.25 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.68 -153.37 15.46 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.95 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.36 -29.77 17.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.098 0.475 . . . . 10.0 110.739 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 19.4 m -93.74 159.68 15.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.83 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.85 134.22 48.24 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.347 -0.982 . . . . 10.0 108.347 178.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.03 -5.96 2.08 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.566 0.541 . . . . 10.0 111.46 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -74.16 127.34 32.7 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.845 0.355 . . . . 10.0 110.466 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -109.69 139.8 44.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -99.62 101.93 13.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.361 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 t -70.5 109.24 2.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.101 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.445 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.699 0.285 . . . . 10.0 110.985 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -101.68 105.43 16.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 36.5 mt -91.1 113.44 25.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.808 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 33.3 mt -100.6 119.4 48.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -93.09 166.24 12.44 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.673 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -16.97 44.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -85.67 -3.77 58.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.799 0.333 . . . . 10.0 110.729 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.59 18.28 60.45 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.584 -0.817 . . . . 10.0 112.713 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 135.9 33.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -104.65 113.23 26.67 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.999 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.87 113.02 26.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.692 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 22.3 mm -98.82 117.91 44.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -103.83 137.97 30.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.544 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -60.02 134.44 57.05 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -51.69 -43.6 62.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.854 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -51.89 -51.61 55.6 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.96 0.41 . . . . 10.0 111.744 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -74.22 -37.28 63.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.332 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.63 95.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.479 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.74 -49.6 77.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.815 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 3.1 m -63.15 -36.61 84.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.981 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.2 m -67.16 -33.14 74.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 10.0 110.407 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.1 -11.69 84.65 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.398 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 -18.26 47.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 10.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -83.75 160.53 3.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.394 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -73.74 86.43 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.136 0.493 . . . . 10.0 111.059 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -99.24 173.44 6.79 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.829 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.0 mmm -78.58 31.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.873 0.323 . . . . 10.0 111.873 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 tp -65.25 -31.99 73.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.568 . . . . 10.0 109.809 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.5 14.19 19.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.466 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.6 -60.29 5.51 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.865 -0.607 . . . . 10.0 113.185 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.91 179.76 2.56 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.345 2.03 . . . . 10.0 112.461 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.21 -55.44 18.7 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.289 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -142.13 121.29 12.99 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.784 -0.245 . . . . 10.0 110.824 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.91 91.24 5.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.6 159.83 26.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.047 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -60.58 -25.37 66.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.497 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.2 -35.1 71.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.073 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.05 -28.77 64.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.388 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.02 -16.11 60.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -85.12 -52.38 5.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.385 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -129.56 99.06 5.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.376 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -83.52 114.72 24.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.628 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -90.33 109.11 20.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.869 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -106.76 94.47 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 10.0 111.374 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -89.89 156.71 18.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 70.95 16.6 6.47 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.234 0.54 . . . . 10.0 111.305 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 75.8 mt -130.15 117.94 18.19 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.708 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -65.55 138.83 56.13 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.791 2.327 . . . . 10.0 111.806 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -59.95 -40.85 90.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -50.04 61.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.902 -0.59 . . . . 10.0 112.392 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.0 m -73.87 -27.4 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 120.942 -0.303 . . . . 10.0 111.593 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.86 -39.36 93.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.512 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -35.34 72.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.86 0.362 . . . . 10.0 110.791 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.14 -35.11 77.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.116 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.0 t -67.24 -47.44 81.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 35.9 m -59.56 -40.53 87.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.462 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -65.69 -42.51 91.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.849 179.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -65.44 -40.58 93.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.817 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -61.7 -47.34 85.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.925 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.5 m -60.58 -42.21 96.23 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.972 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -62.86 -42.53 99.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.325 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -64.13 -37.54 87.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.167 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.82 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.006 0.431 . . . . 10.0 110.089 179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -72.79 -42.31 64.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.185 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -57.25 -48.44 78.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.662 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 50.06 1.7 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.208 0.528 . . . . 10.0 110.771 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -162.16 -58.44 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.297 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -130.1 -36.92 1.5 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.981 0.42 . . . . 10.0 111.647 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 11.2 m -83.9 37.22 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.68 8.09 23.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.5 0.667 . . . . 10.0 109.694 179.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -99.52 -2.34 36.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.523 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 42.1 pt -115.91 166.54 12.09 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.57 172.36 16.47 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.371 2.047 . . . . 10.0 112.718 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.56 170.32 9.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.036 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -53.94 130.63 57.96 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.766 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.07 118.62 5.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.994 2.463 . . . . 10.0 112.197 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 pt -81.18 42.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.657 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.32 -59.47 0.25 Allowed Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.09 111.16 3.11 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.707 1.604 . . . . 10.0 111.365 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.52 56.37 2.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.681 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 3.9 mm -120.08 9.8 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.465 0.65 . . . . 10.0 110.549 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.28 -26.03 22.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.095 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 15.6 tp -70.87 -27.58 63.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.069 0.461 . . . . 10.0 109.816 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -61.39 -31.65 71.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.668 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 mt -77.5 -35.99 53.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.349 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.2 -23.81 65.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.579 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 38.6 ttp -57.49 -26.95 62.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.27 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.59 -30.85 71.64 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.57 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.87 -65.54 0.28 Allowed 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -82.9 36.56 0.5 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.352 0.501 . . . . 10.0 112.352 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.128 179.241 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.685 -0.166 . . . . 10.0 112.685 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -63.74 1.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -179.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 tp -62.74 -27.93 69.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.501 -179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -58.98 -26.86 64.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.349 0.595 . . . . 10.0 110.765 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -105.01 -38.73 6.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.199 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.86 -38.8 92.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.406 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.33 84.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.682 0.277 . . . . 10.0 110.802 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 tp -67.49 -27.73 67.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.366 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.02 -17.98 44.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.157 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.8 -48.83 6.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.603 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -149.8 124.63 9.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.407 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -95.73 93.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.112 -0.699 . . . . 10.0 109.112 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -98.01 116.75 65.61 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.226 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -90.83 38.18 0.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.951 2.434 . . . . 10.0 111.972 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -94.95 166.58 11.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.237 179.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -79.03 154.84 29.15 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.3 mm -118.41 105.93 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.06 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.5 tttp -122.75 143.46 40.25 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -29.6 130.07 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 124.557 3.505 . . . . 10.0 114.326 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.34 135.4 67.73 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.393 2.729 . . . . 10.0 113.026 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.66 128.33 85.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.839 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -68.95 -13.62 37.02 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.099 2.533 . . . . 10.0 112.986 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.06 -35.67 80.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.974 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -129.78 -122.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.995 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -160.2 58.09 0.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.19 0.519 . . . . 10.0 110.956 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 tttm -152.31 154.56 35.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.682 -0.69 . . . . 10.0 109.256 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -77.69 152.78 33.57 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.744 0.306 . . . . 10.0 110.536 179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.5 m -87.34 149.22 24.65 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.231 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -105.11 99.71 9.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.851 0.358 . . . . 10.0 110.285 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -149.78 -74.76 0.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.148 -0.478 . . . . 10.0 109.959 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.431 ' C ' ' HE ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.69 -68.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 179.002 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.3 m0 . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.255 179.342 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.051 0.453 . . . . 10.0 110.334 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.51 132.36 35.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.707 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.5 t -121.4 116.57 50.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.707 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -107.35 113.24 26.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.01 158.4 38.0 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.866 0.365 . . . . 10.0 111.323 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 57.3 mtm -128.51 109.25 11.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.642 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mm -83.51 110.14 17.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -107.86 108.1 19.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -91.69 71.48 5.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.593 -1.262 . . . . 10.0 107.593 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 67.19 -77.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.482 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -110.27 -7.61 14.82 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -106.36 104.49 14.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.519 0.2 . . . . 10.0 111.394 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.5 m -101.04 118.08 36.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.783 0.325 . . . . 10.0 110.568 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -110.86 123.85 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.743 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -81.08 125.17 29.87 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.6 m -118.07 119.2 34.03 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.161 0.505 . . . . 10.0 111.6 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -104.91 101.55 11.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.318 -0.993 . . . . 10.0 108.318 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.72 -171.2 2.32 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.89 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -124.35 162.41 23.86 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -61.11 -22.94 65.13 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.345 0.498 . . . . 10.0 112.345 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -2.07 47.04 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -91.88 144.54 25.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.531 0.205 . . . . 10.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 32.3 p -93.31 167.31 11.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.078 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 75.5 t -66.3 -34.54 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.865 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -62.14 -36.37 81.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 10.0 110.357 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.66 -33.2 75.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.835 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -63.39 -45.95 88.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 10.0 109.928 179.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.52 -32.54 73.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.529 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -64.79 -37.46 87.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.037 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -69.01 -44.48 81.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.44 -33.64 57.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.482 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -59.8 -34.22 72.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.96 -0.563 . . . . 10.0 111.058 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.7 -19.29 58.39 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.542 -0.837 . . . . 10.0 112.844 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.7 mt -89.24 -57.91 3.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 10.0 111.66 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 39.8 mt -91.86 -8.12 47.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.854 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 mttt 58.78 51.2 7.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.368 0.604 . . . . 10.0 110.817 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -125.02 133.65 25.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.052 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.37 125.57 19.25 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.928 2.418 . . . . 10.0 112.294 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.69 -21.84 73.04 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.225 2.616 . . . . 10.0 113.059 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -64.39 -33.23 75.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.1 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -94.14 -2.77 52.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.059 -179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -82.64 126.85 32.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.54 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 86.7 mmt-85 -120.02 110.86 17.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 54.0 mt -92.86 118.08 30.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.905 0.383 . . . . 10.0 111.062 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -112.98 117.57 32.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.724 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -128.99 137.69 51.5 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.317 -0.994 . . . . 10.0 108.317 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 66.28 27.25 10.21 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.514 0.509 . . . . 10.0 109.749 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 67.89 17.07 9.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.773 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -132.12 169.79 15.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 41.7 tp -85.24 135.07 34.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.955 0.407 . . . . 10.0 111.202 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 65.2 mt -79.0 150.23 32.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.532 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.19 113.64 25.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.0 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.02 -28.01 64.08 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.651 0.611 . . . . 10.0 112.651 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.64 -11.62 68.16 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.425 -178.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -95.29 153.74 17.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.968 0.413 . . . . 10.0 110.796 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 32.6 p -83.37 165.54 19.18 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.23 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.35 -44.73 88.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.486 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.16 -33.07 64.04 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.451 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.57 -29.57 52.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.946 0.403 . . . . 10.0 111.086 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 36.9 m -83.58 14.37 3.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 111.696 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 81.66 12.35 81.72 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 121.081 -0.581 . . . . 10.0 112.905 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -87.79 85.7 7.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.003 0.43 . . . . 10.0 110.321 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 47.1 p -114.42 165.23 12.95 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.435 -0.58 . . . . 10.0 109.435 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 9.7 m -65.54 -5.15 7.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.897 0.379 . . . . 10.0 111.971 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -81.8 -46.35 14.31 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.233 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.31 -35.14 18.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.937 179.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -101.35 93.31 5.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.275 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -109.43 157.84 36.23 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.666 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.61 -17.17 58.7 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.402 2.068 . . . . 10.0 111.518 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.13 -5.76 21.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.507 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -157.54 89.48 2.44 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.723 -179.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -79.14 138.29 14.19 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.966 2.444 . . . . 10.0 111.941 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.67 117.45 8.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.533 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -80.1 125.59 30.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.086 0.47 . . . . 10.0 111.672 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 32.0 t -119.3 139.27 47.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.456 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.18 131.25 10.54 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.582 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -109.64 99.36 8.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.873 0.368 . . . . 10.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.51 113.42 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -96.05 117.35 30.5 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.64 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -71.87 91.57 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.224 0.535 . . . . 10.0 111.221 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -99.64 129.96 45.83 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.19 129.88 41.7 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.38 19.86 11.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.624 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.0 m -117.08 112.96 21.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.853 0.359 . . . . 10.0 110.127 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -74.09 -6.37 47.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.127 0.788 . . . . 10.0 113.127 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -62.91 -32.6 73.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.935 0.398 . . . . 10.0 111.341 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.95 -37.45 74.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.89 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.25 -15.27 61.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.928 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.92 -26.06 17.77 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 mt -84.11 -11.82 11.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 10.0 110.982 -179.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -85.67 113.36 50.74 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.847 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.68 -14.94 45.91 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.047 2.498 . . . . 10.0 111.827 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -74.0 -37.38 64.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.262 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -96.67 -44.86 6.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.817 0.341 . . . . 10.0 111.021 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.9 m -111.45 138.98 21.57 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.657 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.04 153.75 76.77 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.386 2.057 . . . . 10.0 111.519 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -52.51 126.85 22.07 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.036 2.491 . . . . 10.0 112.575 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -70.31 107.29 3.69 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.259 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.0 tp -138.77 126.74 13.64 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.91 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.13 127.01 21.74 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.589 2.193 . . . . 10.0 111.778 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.66 -31.26 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.735 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 20.7 m -67.5 -14.67 18.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.683 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 79.9 mmm -114.51 10.69 16.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.129 0.49 . . . . 10.0 109.873 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -78.27 -53.42 1.35 Allowed Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 112.834 0.679 . . . . 10.0 112.834 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.93 71.43 6.2 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.474 2.116 . . . . 10.0 112.356 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -135.73 167.73 20.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.0 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.62 159.3 19.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.944 0.402 . . . . 10.0 111.735 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -82.82 138.22 34.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -93.64 -174.7 39.97 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 121.085 -0.578 . . . . 10.0 112.312 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -33.18 67.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.992 0.425 . . . . 10.0 111.546 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.25 159.55 20.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.166 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.56 121.73 15.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.332 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.28 13.53 6.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.921 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -73.36 128.66 36.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -106.4 130.42 54.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.799 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.97 107.81 16.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.352 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -72.05 126.7 33.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.085 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.3 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.022 0.439 . . . . 10.0 110.775 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -110.57 119.0 37.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.742 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 43.2 mt -99.92 129.83 46.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.058 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 37.4 mt -113.5 119.91 62.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.7 p -89.64 168.36 12.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.178 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -69.15 -16.57 63.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.825 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -81.05 -16.71 52.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.94 0.4 . . . . 10.0 110.542 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 98.7 13.25 41.32 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.409 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -90.82 130.37 36.79 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.821 -0.436 . . . . 10.0 109.821 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -98.7 134.3 41.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.106 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -124.31 123.25 39.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.675 0.274 . . . . 10.0 111.29 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 33.2 mm -102.14 114.56 41.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 t -97.63 141.43 15.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.414 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -61.8 121.97 14.2 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -51.36 -39.91 58.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.764 0.653 . . . . 10.0 112.764 -178.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -58.37 -52.37 65.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.809 0.337 . . . . 10.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -68.46 -33.01 73.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.091 0.472 . . . . 10.0 110.49 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.82 88.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.688 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 85.2 mt -61.67 -45.28 94.7 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.883 -0.414 . . . . 10.0 109.883 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.45 -38.64 91.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.975 178.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -65.53 -36.78 84.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.286 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.72 -8.49 81.77 Favored Glycine 0 C--N 1.33 0.209 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.334 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 18.7 m -81.36 -20.96 39.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.393 0.616 . . . . 10.0 109.578 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.7 mt -84.06 159.03 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.175 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -76.11 81.19 2.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.143 0.497 . . . . 10.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.28 -163.19 0.85 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.876 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 83.9 mmm -101.76 27.39 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.64 -0.254 . . . . 10.0 111.453 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.91 -36.45 84.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.265 0.555 . . . . 10.0 110.495 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.2 m -91.58 14.32 15.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.397 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -57.75 4.94 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-N 115.823 -0.626 . . . . 10.0 113.16 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.44 -160.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.686 2.258 . . . . 10.0 111.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.37 -110.64 0.16 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.78 -0.724 . . . . 10.0 112.285 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -86.69 123.97 32.44 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 122.753 -0.263 . . . . 10.0 110.612 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -101.25 74.99 1.6 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.005 0.431 . . . . 10.0 110.105 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.15 158.44 33.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.335 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.03 -27.77 63.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.03 -35.82 77.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.02 0.438 . . . . 10.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -84.87 -21.7 29.66 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.74 -0.663 . . . . 10.0 109.824 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.1 m -77.72 -40.11 42.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.517 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -68.0 -47.31 68.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.862 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -124.82 90.43 3.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.18 115.63 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.886 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -91.98 111.96 23.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.917 0.389 . . . . 10.0 110.804 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -97.36 114.85 26.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.112 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -100.11 147.13 26.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.221 -0.445 . . . . 10.0 109.887 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 65.52 21.41 11.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.749 0.655 . . . . 10.0 110.839 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 90.0 mt -129.59 109.49 17.42 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-O 121.079 0.466 . . . . 10.0 111.131 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -63.77 150.98 87.17 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.135 2.557 . . . . 10.0 112.13 179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.2 p -64.99 -38.96 92.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.411 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -54.24 46.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.78 -0.645 . . . . 10.0 112.294 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 m -67.81 -34.62 68.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.638 -0.255 . . . . 10.0 111.334 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.53 -37.93 89.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.62 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -58.05 -40.71 81.62 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.543 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -67.55 -35.59 79.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.567 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 59.4 t -64.26 -46.49 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.847 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.4 m -60.66 -39.49 88.58 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.158 -0.473 . . . . 10.0 110.628 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 52.6 mtm -67.29 -41.45 85.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.334 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -62.11 -42.87 99.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.49 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.49 -47.2 86.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.266 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -61.06 -42.45 98.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.161 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.18 -44.82 90.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.078 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . 0.445 ' HZ3' ' CD ' ' C' ' 74' ' ' GLU . 27.6 tptt -59.93 -42.14 93.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.612 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 51.3 t -59.12 -50.94 77.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.313 179.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -66.9 -42.33 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.733 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.8 -43.75 85.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.231 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 15.88 14.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.115 0.484 . . . . 10.0 111.18 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.93 -59.24 2.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.173 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.43 -30.14 0.56 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.389 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 10.4 m -80.82 47.58 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.941 0.4 . . . . 10.0 111.59 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.56 4.61 53.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.602 0.715 . . . . 10.0 110.018 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -80.83 -26.03 37.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.05 -0.977 . . . . 10.0 109.656 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.15 167.28 12.69 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.787 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -80.34 179.88 5.78 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.276 1.984 . . . . 10.0 112.574 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . 0.445 ' CD ' ' HZ3' ' C' ' 62' ' ' LYS . 9.6 tp10 -69.65 168.64 14.42 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.651 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -48.23 127.57 12.41 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 122.382 0.273 . . . . 10.0 111.624 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -48.46 128.15 17.26 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.657 2.905 . . . . 10.0 113.614 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 13.2 pt -83.08 50.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.383 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.2 -57.59 0.13 Allowed Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.9 120.13 6.95 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.605 1.537 . . . . 10.0 111.098 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -71.44 -8.18 52.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mm -79.54 83.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.491 0.662 . . . . 10.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 -41.98 0.16 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.867 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 11.8 tp -68.1 -25.57 65.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.506 -0.77 . . . . 10.0 108.981 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 20.9 mp0 -61.17 -36.14 79.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.64 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 38.5 mt -74.56 -33.57 62.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.838 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 5.0 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.171 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 28.0 ttp -60.48 -20.98 61.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.672 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.02 -30.56 71.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.449 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.14 -61.68 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.4 41.74 0.63 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.251 0.548 . . . . 10.0 111.369 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.823 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.194 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.406 -0.278 . . . . 10.0 112.406 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -61.26 2.5 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.0 tp -62.89 -28.76 70.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.231 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -55.99 -29.7 60.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.489 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -104.89 -34.63 7.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.979 0.418 . . . . 10.0 110.661 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -40.82 97.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 10.0 112.0 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.22 68.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.773 0.321 . . . . 10.0 111.058 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 tp -66.04 -34.88 79.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.332 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.74 -13.44 56.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.543 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.34 -42.11 13.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.239 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -158.95 116.77 2.84 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.24 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.5 mt -85.58 88.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 178.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -97.62 103.7 17.64 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.737 -179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -91.57 72.73 0.8 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.248 2.632 . . . . 10.0 111.452 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -131.68 169.71 15.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.497 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -85.09 149.04 25.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.697 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mm -102.02 129.53 53.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.202 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.04 145.16 54.55 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.228 -1.027 . . . . 10.0 108.228 178.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -36.14 131.05 0.36 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.693 2.928 . . . . 10.0 112.678 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -54.89 152.64 28.22 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 123.401 2.734 . . . . 10.0 113.233 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 mt -74.44 117.99 66.4 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.837 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.15 -23.54 52.8 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.726 2.284 . . . . 10.0 112.287 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.26 61.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.63 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.3 t -108.07 -132.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.27 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -158.49 56.29 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 10.0 110.525 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttm -152.09 149.75 29.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.334 -0.848 . . . . 10.0 108.876 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.07 154.52 40.39 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.715 0.293 . . . . 10.0 111.108 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 m -93.29 165.7 12.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.162 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -113.62 127.74 56.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.592 0.234 . . . . 10.0 110.629 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -172.19 -79.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.795 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.84 -54.44 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 . . . . . 0 C--O 1.247 0.961 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.081 179.944 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmm? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 120.572 0.225 . . . . 10.0 111.482 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.15 115.5 1.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.75 122.11 63.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.272 0.558 . . . . 10.0 111.318 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -108.13 105.25 14.9 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.629 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.31 150.4 32.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.031 0.443 . . . . 10.0 111.499 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 38.5 ttm -120.91 101.36 7.64 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.47 -179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.5 mm -80.94 113.56 20.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -111.63 101.87 10.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -89.75 73.63 7.56 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 65.09 -81.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.529 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -114.76 0.37 13.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.787 0.327 . . . . 10.0 111.603 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.7 m -106.72 100.03 9.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.158 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 50.2 m -93.89 127.51 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.866 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.35 117.34 51.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.305 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -82.69 119.01 23.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 1.7 m -113.65 113.01 24.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.203 0.525 . . . . 10.0 112.16 -179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 99.79 10.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.581 -1.266 . . . . 10.0 107.581 178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.8 -166.18 1.56 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.517 -0.311 . . . . 10.0 111.288 -178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -128.03 158.21 38.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.842 -0.429 . . . . 10.0 109.842 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -56.78 -31.03 64.24 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.365 0.505 . . . . 10.0 112.365 -179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -17.38 64.68 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 49.5 m -79.43 142.59 35.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.71 0.29 . . . . 10.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 25.2 p -90.47 167.11 12.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.798 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.3 t -65.12 -32.59 58.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.014 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.01 -38.07 89.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.064 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.95 -31.18 72.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.935 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.85 -42.22 95.07 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.437 ' HZ1' ' CG ' ' B' ' 53' ' ' ASP . 97.4 mttt -61.58 -36.12 79.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.648 -0.706 . . . . 10.0 110.245 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.03 -37.61 87.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.2 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -69.28 -47.8 71.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.538 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.23 -39.4 80.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.638 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -58.79 -38.29 78.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.377 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.25 -11.83 84.65 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.809 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 72.3 mt -103.22 -51.51 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.865 0.364 . . . . 10.0 111.474 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 41.2 mt -84.25 -16.0 44.79 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.494 0.553 . . . . 10.0 112.494 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 mttt 62.05 45.45 7.23 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.531 0.681 . . . . 10.0 110.609 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.4 mtt-85 -133.3 143.66 49.13 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.529 -0.76 . . . . 10.0 109.972 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.79 131.6 46.59 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.12 2.547 . . . . 10.0 112.755 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.05 -16.68 36.4 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.872 2.381 . . . . 10.0 112.036 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.64 -28.21 69.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.434 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -104.93 13.34 31.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.82 0.343 . . . . 10.0 111.812 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -92.48 127.68 38.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.865 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 43.1 mmt-85 -117.37 111.76 19.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.416 -0.357 . . . . 10.0 110.616 179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.1 mt -95.97 113.64 25.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.556 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -109.45 115.96 30.92 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.236 0.541 . . . . 10.0 112.435 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -115.43 127.27 55.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.404 -0.816 . . . . 10.0 108.919 178.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 61.91 35.87 16.11 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.51 0.506 . . . . 10.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.15 9.11 7.21 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.394 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -119.7 160.33 22.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.142 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 tp -85.66 139.0 31.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.644 0.259 . . . . 10.0 110.882 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -79.51 170.72 16.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.882 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -112.88 120.47 41.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.945 0.402 . . . . 10.0 110.754 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.437 ' CG ' ' HZ1' ' B' ' 28' ' ' LYS . 0.9 OUTLIER -64.04 -25.99 68.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.297 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.88 13.33 66.29 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.813 -0.708 . . . . 10.0 113.179 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.77 155.17 43.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.034 0.445 . . . . 10.0 111.349 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 24.8 p -87.25 168.58 13.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.166 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 51.3 mt -60.79 -39.66 89.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.838 0.351 . . . . 10.0 110.654 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.8 -27.71 67.09 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.851 -0.613 . . . . 10.0 112.623 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.0 -26.56 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.061 0.457 . . . . 10.0 110.782 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.0 m -82.46 2.78 31.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.846 -0.615 . . . . 10.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.22 15.95 59.88 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.906 -0.664 . . . . 10.0 113.018 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -86.61 87.39 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.818 0.342 . . . . 10.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.2 p -108.8 170.26 8.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 33.9 m -70.62 -3.78 19.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.079 0.466 . . . . 10.0 111.113 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -88.36 -43.17 11.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -79.05 -30.45 44.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.073 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -118.41 106.57 12.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.03 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -113.01 160.08 32.26 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.806 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.85 -24.47 47.43 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.987 2.458 . . . . 10.0 113.025 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.55 12.97 16.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.707 0.289 . . . . 10.0 111.351 179.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -152.83 82.71 4.94 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.741 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.03 133.02 14.65 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.884 2.389 . . . . 10.0 111.726 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 114.7 5.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.41 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.56 125.1 26.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.11 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.06 131.01 73.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.27 133.26 11.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.617 -0.801 . . . . 10.0 111.625 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.2 tp -114.7 108.51 16.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.0 0.429 . . . . 10.0 111.453 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -102.2 141.01 35.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.001 -0.741 . . . . 10.0 109.001 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -119.56 121.63 39.79 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -76.19 96.85 3.99 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.274 0.559 . . . . 10.0 111.456 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -115.43 120.89 41.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.224 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -57.93 132.5 53.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.962 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.28 4.34 4.5 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.369 -0.832 . . . . 10.0 112.693 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 108.79 20.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.11 0.481 . . . . 10.0 110.031 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -82.73 -7.98 59.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.804 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.45 -29.36 66.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.321 179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.8 -38.96 79.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.446 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.04 -27.9 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.539 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 35.0 m -77.14 -26.94 53.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.955 0.407 . . . . 10.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.0 mt -88.2 -21.16 7.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.45 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -76.23 112.56 21.61 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.92 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.63 -7.85 22.01 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.043 2.495 . . . . 10.0 111.959 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.57 -19.13 46.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.163 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -121.39 -35.81 3.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.082 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 8.9 m -119.58 143.71 35.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.106 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.19 142.84 47.05 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.326 2.018 . . . . 10.0 111.143 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.82 128.4 21.48 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.182 2.588 . . . . 10.0 112.625 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -65.9 111.67 3.41 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 tp -137.42 134.91 18.82 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.509 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.87 131.09 26.27 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.867 2.378 . . . . 10.0 112.17 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -69.67 -29.69 67.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.092 0.472 . . . . 10.0 110.577 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.6 m -71.52 -13.01 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.192 0.52 . . . . 10.0 110.76 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 83.9 mmm -116.56 17.58 15.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.781 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -85.25 -54.28 0.44 Allowed Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 112.796 0.665 . . . . 10.0 112.796 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -74.15 73.18 3.87 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.208 1.939 . . . . 10.0 111.747 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -139.61 162.39 35.21 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.25 167.75 15.36 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.874 0.368 . . . . 10.0 111.804 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 131.91 34.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.258 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.38 -154.99 23.92 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.902 -0.665 . . . . 10.0 112.552 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.32 -32.63 17.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.978 0.418 . . . . 10.0 111.149 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 36.2 m -89.11 163.73 15.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.371 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.71 129.13 38.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 68.85 15.18 8.95 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.645 0.591 . . . . 10.0 111.62 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -81.58 121.64 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -103.12 132.91 49.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.828 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.72 109.0 19.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.6 t -78.61 128.36 38.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 10.0 111.68 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.766 0.317 . . . . 10.0 111.446 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -123.08 113.63 19.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.382 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 28.2 mt -83.84 133.3 34.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.167 -0.47 . . . . 10.0 109.845 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.2 mt -117.92 108.82 25.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.2 p -83.61 166.47 18.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.061 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -14.49 60.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 10.0 111.755 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -86.29 -2.64 58.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 10.0 110.604 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.8 23.8 59.24 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.006 -0.616 . . . . 10.0 111.922 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.85 127.58 44.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -94.26 136.49 34.49 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.796 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -123.92 102.5 7.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.873 0.368 . . . . 10.0 111.207 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 mm -87.15 115.04 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 179.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.4 t -102.82 139.24 24.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.291 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 49.0 tttt -62.38 133.57 55.24 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -55.34 -35.86 65.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.869 -179.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -54.04 -44.21 70.82 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.102 0.477 . . . . 10.0 110.953 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -81.16 -43.08 19.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.622 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.11 74.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.361 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.81 -41.06 96.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.86 0.362 . . . . 10.0 110.765 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 3.8 m -65.64 -48.23 72.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 12.3 m -61.01 -33.73 73.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.859 0.362 . . . . 10.0 110.873 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.09 -9.4 71.62 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.052 -0.594 . . . . 10.0 112.345 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 6.0 m -99.44 2.16 44.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.515 0.674 . . . . 10.0 110.052 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.66 160.48 5.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -64.95 101.27 0.48 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 10.0 111.144 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.76 166.92 13.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.161 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 53.6 mmm -76.86 34.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mp -71.61 -25.19 62.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.119 0.485 . . . . 10.0 110.361 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -94.0 16.71 13.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.384 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.74 -56.88 2.53 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.42 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -62.03 166.98 11.39 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.602 2.202 . . . . 10.0 112.706 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.53 92.81 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.887 -0.597 . . . . 10.0 113.069 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -152.93 114.79 4.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.81 0.338 . . . . 10.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -82.31 79.74 8.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.842 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.28 163.06 28.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.273 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -59.67 -19.5 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -64.22 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.31 -20.33 63.88 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.547 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.7 m -74.53 -30.77 61.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.02 0.438 . . . . 10.0 110.647 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -94.06 -55.78 3.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.22 92.95 4.27 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 1.6 t -85.82 97.01 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.172 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -84.09 111.65 19.51 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.927 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -115.72 109.94 18.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -96.74 163.45 12.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.191 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 69.53 7.17 6.09 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.525 0.516 . . . . 10.0 111.72 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 60.1 mt -122.76 106.22 34.71 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.121 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -58.6 145.02 96.76 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.874 2.383 . . . . 10.0 112.024 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.7 p -58.35 -41.29 84.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.503 -179.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.95 -55.64 28.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.917 -0.583 . . . . 10.0 112.361 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.6 m -67.62 -34.41 67.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 121.077 -0.249 . . . . 10.0 111.61 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.08 -33.51 75.93 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 39.2 m -61.89 -39.75 93.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.403 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -65.68 -37.67 87.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.314 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 55.2 t -63.99 -44.88 97.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.575 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.3 m -61.18 -39.65 90.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.649 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.9 mtm -68.29 -38.04 81.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.35 -44.11 95.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.76 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.44 -42.92 98.67 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 78.9 m -59.05 -43.75 91.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.839 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -66.29 -43.6 85.88 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.496 179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -60.87 -41.17 95.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.666 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 50.5 t -57.58 -47.14 85.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 10.0 110.392 179.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -75.11 -40.44 59.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.707 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -58.83 -43.39 90.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.66 -179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.79 18.79 4.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.148 0.499 . . . . 10.0 111.111 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -123.75 -68.82 0.85 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.028 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.48 -23.29 4.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.969 0.414 . . . . 10.0 111.842 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 12.3 m -84.46 27.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.207 0.527 . . . . 10.0 111.808 -179.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -0.32 40.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.26 0.552 . . . . 10.0 110.606 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.86 -17.21 33.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.803 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 33.4 pt -103.44 163.3 17.71 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.836 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -69.16 168.91 19.41 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.928 2.419 . . . . 10.0 112.403 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -70.05 166.87 18.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.082 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -52.12 130.01 40.56 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.859 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -58.49 124.14 15.17 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.809 2.339 . . . . 10.0 112.115 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 11.1 pt -78.19 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.341 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.85 -55.84 0.16 Allowed Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -68.41 103.71 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.25 1.967 . . . . 10.0 111.483 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -74.58 58.68 0.79 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.511 0.559 . . . . 10.0 112.511 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 14.8 mm -122.2 -4.73 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.187 0.517 . . . . 10.0 110.796 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.62 74.82 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.155 -0.34 . . . . 10.0 111.582 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 19.3 tp -68.21 -33.2 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 84' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -63.01 -36.51 83.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.219 -0.9 . . . . 10.0 109.663 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 76.6 mt -74.39 -34.14 63.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.425 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.26 -17.3 64.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.83 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.0 ttp -63.67 -18.27 63.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.793 179.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.51 75.99 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.477 -0.564 . . . . 10.0 109.477 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.71 -68.49 0.14 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.373 -0.831 . . . . 10.0 112.962 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -80.85 47.52 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.345 0.593 . . . . 10.0 111.266 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 10.6 t80 . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 179.695 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 N-CA-C 111.92 -0.472 . . . . 10.0 111.92 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -62.49 1.78 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.778 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -63.24 -31.03 72.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.606 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.484 ' HA ' ' CD1' ' C' ' 86' ' ' LEU . 2.3 tt0 -54.65 -36.45 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.066 0.46 . . . . 10.0 110.972 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -93.45 -39.97 10.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.453 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 90.0 mt -63.42 -29.56 70.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.684 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.27 -40.95 98.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.795 0.331 . . . . 10.0 110.984 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.4 tp -68.04 -31.87 71.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.206 0.527 . . . . 10.0 109.83 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.12 15.71 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.448 -0.796 . . . . 10.0 110.3 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.78 -39.27 2.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.952 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.626 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.3 OUTLIER -164.94 122.6 1.61 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.906 179.418 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.3 mt -89.15 87.51 2.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.65 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 59.3 tttt -100.85 111.33 63.01 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.286 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.96 45.11 0.09 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.332 2.688 . . . . 10.0 111.595 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.526 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 14.4 mttm -95.27 175.77 6.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.131 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.36 152.43 27.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.1 0.476 . . . . 10.0 111.52 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.8 mm -113.51 141.82 28.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.879 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.952 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.4 OUTLIER -160.65 144.59 10.26 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.594 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 50.6 Cg_exo -38.5 136.04 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.331 2.687 . . . . 10.0 112.88 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 25.8 Cg_endo -61.11 134.53 53.23 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 123.119 2.546 . . . . 10.0 112.82 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.24 123.32 87.92 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.254 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.26 -12.72 36.15 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 123.087 2.525 . . . . 10.0 113.074 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -39.54 94.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.122 0.487 . . . . 10.0 110.124 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.545 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.2 t -126.82 -118.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' HG2' HG12 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -163.91 63.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.525 . . . . 10.0 110.476 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.456 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.5 tttm -157.36 153.28 27.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.241 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.3 pp -74.14 148.23 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.736 0.303 . . . . 10.0 110.534 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.638 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.8 m -81.45 163.87 22.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.254 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -111.72 102.22 10.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.748 0.308 . . . . 10.0 110.513 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.952 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -150.67 -82.34 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.301 -0.408 . . . . 10.0 110.613 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.36 -54.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.65 -0.691 . . . . 10.0 109.74 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tmm? . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 121.013 0.435 . . . . 10.0 110.774 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.56 146.67 30.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.813 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.427 HG11 HD13 ' B' ' 57' ' ' LEU . 84.7 t -131.59 118.78 40.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 121.121 0.486 . . . . 10.0 111.362 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.405 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.3 m-85 -108.68 113.86 27.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.94 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.726 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.0 OUTLIER -129.16 159.43 36.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.829 0.347 . . . . 10.0 111.581 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.664 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.9 mtm -127.01 109.02 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.845 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.407 ' CG2' ' HB2' ' B' ' 77' ' ' LEU . 48.5 mm -81.69 103.23 8.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 56.5 ttt180 -101.34 110.94 23.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.382 0.882 . . . . 10.0 113.382 -178.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.423 ' HB2' HD23 ' B' ' 77' ' ' LEU . 5.1 ttp85 -96.18 59.49 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.42 -1.326 . . . . 10.0 107.42 177.271 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 66.3 -83.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.948 -1.023 . . . . 10.0 112.112 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -93.22 -7.59 44.73 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.282 0.475 . . . . 10.0 112.282 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.47 HG23 ' HB2' ' C' ' 10' ' ' GLU . 2.0 m -120.84 108.41 13.9 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.738 0.273 . . . . 10.0 111.738 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 28.2 m -103.06 120.65 41.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 10.0 110.384 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.624 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.5 mt -108.01 118.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.735 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -77.19 118.56 19.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.726 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.8 OUTLIER -111.61 124.32 52.06 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.119 0.485 . . . . 10.0 111.221 -179.152 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.514 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.0 t70 -110.71 97.63 7.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.36 -167.82 1.62 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.829 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -126.33 164.21 21.54 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.47 -22.96 62.3 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -85.61 -5.23 59.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 13.5 m -82.24 142.71 31.91 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.1 p -90.99 165.38 13.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.779 0.323 . . . . 10.0 110.921 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.532 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 76.7 t -65.62 -34.45 70.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.215 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' B' ' 29' ' ' ARG . 62.1 t80 -61.4 -36.09 79.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -62.69 -38.38 90.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.722 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.652 HD11 HD21 ' B' ' 57' ' ' LEU . 40.4 mt -61.38 -42.99 99.6 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.013 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.88 -37.46 86.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' B' ' 25' ' ' PHE . 62.6 mtp180 -65.82 -34.92 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.041 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 95.2 mt -66.98 -46.31 85.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.04 -37.13 77.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.746 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.56 -39.98 85.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.671 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.6 -1.54 77.37 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.926 -0.654 . . . . 10.0 113.312 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 82.6 mt -114.41 -53.6 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.887 0.375 . . . . 10.0 111.398 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 60.7 mt -90.38 -6.84 54.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.591 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mptt 60.07 38.81 20.35 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.152 0.501 . . . . 10.0 111.678 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.419 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 26.6 mmt180 -116.42 133.1 23.02 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.463 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 44.6 Cg_exo -57.18 133.83 60.12 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 123.073 2.516 . . . . 10.0 112.255 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.5 -22.81 58.43 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.249 2.633 . . . . 10.0 112.614 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -61.5 -37.15 82.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.35 -1.02 57.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.784 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -85.44 135.68 33.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.921 0.391 . . . . 10.0 111.159 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 65.1 mmt-85 -128.0 116.35 19.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.004 178.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 71.7 mt -98.84 118.44 35.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.034 0.445 . . . . 10.0 111.05 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -115.55 112.44 22.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.491 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.55 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.3 tttm -112.78 132.14 55.38 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.68 30.02 19.61 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.107 0.479 . . . . 10.0 110.412 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 68.37 24.19 7.35 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.234 -0.894 . . . . 10.0 111.587 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -130.92 151.47 51.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.127 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.33 130.05 34.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.751 0.31 . . . . 10.0 111.034 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' B' ' 46' ' ' LYS . 95.0 mt -81.93 156.58 24.68 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -99.22 121.99 41.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.739 0.304 . . . . 10.0 110.527 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.532 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 8.5 m-20 -58.51 -29.31 66.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.646 -0.706 . . . . 10.0 112.399 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.57 2.53 84.76 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.002 -0.618 . . . . 10.0 112.872 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -106.94 154.27 21.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.986 0.422 . . . . 10.0 111.177 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 22.5 p -88.78 162.56 16.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.165 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.652 HD21 HD11 ' B' ' 27' ' ' LEU . 24.9 mt -56.98 -36.83 70.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.597 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -34.5 87.14 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.239 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -83.65 -14.12 52.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.049 0.452 . . . . 10.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' CYS . . . . . 0.543 ' HB3' HD22 ' B' ' 51' ' ' LEU . 58.8 m -95.34 6.46 48.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.108 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.96 33.3 37.24 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.404 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.445 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 24.9 m-85 -94.93 55.09 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.096 0.474 . . . . 10.0 110.618 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.19 148.42 48.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m -60.68 -16.77 42.63 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.77 -26.91 34.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.957 0.408 . . . . 10.0 110.341 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.87 -38.87 12.06 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -103.21 82.69 2.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.985 -1.007 . . . . 10.0 108.883 179.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.55 158.21 34.1 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.769 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.69 -15.81 30.18 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.319 2.013 . . . . 10.0 110.696 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.492 ' HB3' ' HE1' ' C' ' 75' ' ' PHE . 0.7 OUTLIER -94.29 -16.57 23.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.939 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.41 93.7 1.41 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.119 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.664 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.6 Cg_exo -72.99 149.73 47.42 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.928 2.419 . . . . 10.0 112.086 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.58 116.29 10.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.017 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.21 115.78 16.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.147 0.499 . . . . 10.0 111.777 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.09 133.46 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -81.68 130.06 9.45 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.017 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.423 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.7 tp -109.74 108.42 18.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.982 0.42 . . . . 10.0 111.197 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.74 123.64 46.05 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.652 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -101.11 118.27 36.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -76.29 121.37 22.86 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.09 0.472 . . . . 10.0 111.658 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.87 149.3 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -79.22 133.69 36.68 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.981 -0.288 . . . . 10.0 110.726 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 t70 75.31 -32.84 0.22 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.894 0.701 . . . . 10.0 112.894 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.8 m -69.53 110.9 5.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.961 0.41 . . . . 10.0 110.562 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -84.96 7.35 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.032 0.444 . . . . 10.0 111.61 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.64 -28.04 68.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.26 92.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.97 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -60.57 -30.62 69.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.541 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 44.2 m -70.08 -26.95 64.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.625 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.432 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 1.5 mt -101.11 2.11 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.832 0.348 . . . . 10.0 111.235 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.49 110.04 44.4 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.202 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' B' ' 95' ' ' SER . 32.0 Cg_exo -62.27 -16.12 49.06 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 123.055 2.503 . . . . 10.0 111.93 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -79.14 1.63 23.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.605 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 16.6 m -142.72 -45.71 0.31 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.501 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.54 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 22.3 m -108.38 133.74 20.47 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.081 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.87 153.63 47.9 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.378 2.052 . . . . 10.0 110.672 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -50.01 120.08 5.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.008 2.472 . . . . 10.0 111.915 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -60.53 121.79 13.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.603 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.1 tp -144.91 122.98 6.54 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 10.0 109.903 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.59 133.78 47.48 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.626 2.217 . . . . 10.0 111.153 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' ASP . . . . . 0.492 ' O ' ' HD3' ' B' ' 105' ' ' PRO . 17.8 t70 -61.21 -35.88 78.39 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 29' ' ' VAL . 23.0 m -69.54 -18.42 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.112 0.482 . . . . 10.0 111.041 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.603 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.7 mmm -110.2 27.91 9.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.506 0.669 . . . . 10.0 109.35 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.457 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 31.1 ttpt -103.22 -49.73 0.15 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.471 -0.786 . . . . 10.0 113.005 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.492 ' HD3' ' O ' ' B' ' 101' ' ' ASP . 5.3 Cg_exo -76.09 51.09 3.03 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.828 2.352 . . . . 10.0 112.16 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.7 mt-30 -123.47 177.3 5.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.594 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.03 -174.4 2.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.728 0.299 . . . . 10.0 111.512 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -93.76 158.31 15.73 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.9 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.6 -137.96 8.28 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.938 -0.648 . . . . 10.0 112.751 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -17.87 22.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.856 0.36 . . . . 10.0 111.532 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 74.7 m -148.86 -174.43 4.62 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.062 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.64 151.19 42.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.67 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.2 t30 73.14 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.354 0.872 . . . . 10.0 113.354 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.458 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 40.1 tt0 -74.28 133.72 42.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.044 0.449 . . . . 10.0 111.702 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -117.09 159.1 23.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.639 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.0 106.29 12.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.946 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 t -73.04 123.97 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.128 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.325 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.972 0.415 . . . . 10.0 110.868 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' C' ' 41' ' ' GLU . 42.6 tttm -114.19 106.11 13.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.606 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.519 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 64.1 mt -89.89 141.37 28.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.671 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.416 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 21.0 mt -126.98 121.55 58.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -95.78 169.69 9.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.946 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -25.19 65.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.038 -0.528 . . . . 10.0 112.424 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -82.18 6.18 17.4 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.667 0.27 . . . . 10.0 111.382 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.99 23.25 76.69 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 10.0 111.638 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -94.67 124.98 39.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.47 ' HB2' HG23 ' B' ' 12' ' ' THR . 21.0 mt-10 -96.53 137.58 35.39 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.266 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.519 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -125.69 113.87 17.91 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.257 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.624 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.1 mm -92.94 116.99 35.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.725 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -103.6 134.64 44.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.686 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.514 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 81.5 tttt -66.1 128.42 36.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.471 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 19.0 ttt-85 -54.57 -27.6 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.821 0.674 . . . . 10.0 112.821 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -57.2 -41.78 80.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.022 0.439 . . . . 10.0 110.702 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 -85.69 -32.7 21.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.206 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 18' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -60.71 -40.16 91.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.552 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 99.1 mt -57.46 -44.96 85.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.832 0.349 . . . . 10.0 111.089 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -36.12 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.664 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -66.4 -34.41 77.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.095 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.07 -22.32 75.91 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.31 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -71.47 -28.41 63.92 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.293 0.568 . . . . 10.0 110.216 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 20.9 mt -84.47 141.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -65.38 100.24 0.47 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.931 0.396 . . . . 10.0 110.7 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -101.46 178.01 4.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.491 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.586 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 21.6 mmm -78.22 26.33 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 58.5 mt -74.41 -29.93 61.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.151 0.5 . . . . 10.0 110.256 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -90.44 -0.14 57.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.026 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.93 -62.21 5.7 Favored Glycine 0 CA--C 1.52 0.378 0 CA-C-N 115.765 -0.652 . . . . 10.0 113.348 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.36 174.45 3.41 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.666 2.244 . . . . 10.0 112.52 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.98 -62.12 6.01 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.989 -0.624 . . . . 10.0 112.391 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -130.5 125.9 35.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.808 0.337 . . . . 10.0 111.212 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -109.75 75.7 0.96 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.47 165.8 9.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.332 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -53.54 -39.39 64.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.907 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.08 -39.43 92.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.886 0.374 . . . . 10.0 110.516 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.16 -26.27 65.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.637 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -79.06 -17.87 54.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.315 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -90.78 -55.69 3.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.11 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' C' ' 2' ' ' LYS . 69.8 mm-40 -110.45 96.4 6.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 t -95.1 103.1 14.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.075 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 43' ' ' ASN . . . . . 0.416 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 17.6 t-20 -95.33 122.16 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.085 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.642 ' HB3' HD12 ' C' ' 47' ' ' ILE . 83.7 m-85 -104.21 139.82 38.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.703 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -109.27 138.58 45.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.747 0.308 . . . . 10.0 111.297 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 68.97 8.26 6.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.387 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.642 HD12 ' HB3' ' C' ' 44' ' ' PHE . 85.1 mt -108.54 108.7 61.17 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.277 -0.419 . . . . 10.0 110.501 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.62 149.49 84.02 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.941 2.427 . . . . 10.0 112.046 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 2.6 p -60.28 -38.69 84.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.437 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -55.5 30.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.228 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 21.7 m -66.99 -34.44 69.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.238 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.57 -35.54 81.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.549 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 53' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' C' ' 57' ' ' MET . 46.5 m -61.47 -42.55 98.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.551 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -64.52 -36.74 85.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.39 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 96.1 t -64.75 -46.85 90.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.71 -41.63 97.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.994 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 57' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' C' ' 53' ' ' SER . 44.1 mtm -65.81 -39.58 91.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.511 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.469 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 73.8 t80 -65.27 -41.36 94.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.036 -0.357 . . . . 10.0 110.036 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.6 -46.99 85.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.901 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 32.8 m -58.16 -46.51 85.57 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.722 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -61.37 -46.81 88.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.63 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -61.62 -38.05 86.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.509 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 24.5 t -58.58 -44.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.093 0.473 . . . . 10.0 110.417 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.3 mmt85 -78.28 -41.38 34.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.153 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.553 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 82.7 t80 -57.29 -49.03 77.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.919 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.04 15.18 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.915 0.388 . . . . 10.0 111.437 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 67' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 6.6 t30 -119.09 -75.86 0.58 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.628 0.251 . . . . 10.0 111.078 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.66 17.48 5.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 10.0 111.635 -179.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.553 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 66.2 m -126.25 32.32 5.24 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.021 0.438 . . . . 10.0 111.246 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.88 3.48 33.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 10.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.69 -23.49 49.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.874 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.627 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 47.4 pt -94.87 164.59 19.11 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.608 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.627 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 62.5 Cg_endo -73.48 169.63 21.84 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.394 2.063 . . . . 10.0 111.706 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.62 163.73 10.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.788 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.492 ' HE1' ' HB3' ' B' ' 70' ' ' GLN . 26.7 t80 -46.95 131.7 8.82 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.969 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -57.94 113.27 1.45 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.962 2.442 . . . . 10.0 111.656 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.0 pt -78.71 45.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.742 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.662 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -84.3 -58.01 0.38 Allowed Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.662 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 5.0 Cg_exo -79.98 108.93 2.3 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.202 1.934 . . . . 10.0 111.169 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.65 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -76.93 62.01 2.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.479 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 4.3 mm -119.15 4.28 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.27 0.557 . . . . 10.0 110.611 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.556 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -77.38 -28.74 52.94 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.15 -0.344 . . . . 10.0 111.128 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.6 tp -70.38 -29.8 66.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.476 -0.564 . . . . 10.0 109.476 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 9.1 mp0 -61.99 -33.95 75.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.184 -0.916 . . . . 10.0 109.608 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.778 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -75.63 -32.62 60.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.495 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.484 ' CD1' ' HA ' ' A' ' 9' ' ' GLN . 52.0 tp -69.45 -17.57 63.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.71 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 87' ' ' MET . . . . . 0.458 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 30.5 ttp -64.72 -21.74 66.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.704 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.93 -31.44 72.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.74 -56.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.312 0.856 . . . . 10.0 113.312 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -86.11 56.23 3.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.112 0.482 . . . . 10.0 111.185 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.586 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.879 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 112.213 -0.355 . . . . 10.0 112.213 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.561 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.7 OUTLIER -82.42 -53.67 5.82 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 122.483 0.313 . . . . 10.0 111.797 -179.029 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' C' ' 85' ' ' LEU . 31.7 tp -59.92 -28.64 67.77 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.959 0.409 . . . . 10.0 110.57 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -55.87 -28.97 59.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.132 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -107.11 -36.36 6.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.468 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.559 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.1 mt -60.07 -40.97 91.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.906 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.28 -34.49 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.883 0.373 . . . . 10.0 111.223 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.65 -38.36 90.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.85 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.64 -11.48 59.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.164 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -34.5 14.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.846 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.645 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.6 OUTLIER -159.01 112.31 2.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.098 0.475 . . . . 10.0 111.122 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -81.65 90.91 2.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.557 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 62.8 tttt -101.03 106.96 47.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.273 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -94.7 35.77 0.17 Allowed 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.337 2.691 . . . . 10.0 111.91 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.5 mttm -89.85 175.43 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.113 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -75.42 159.85 30.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.185 0.517 . . . . 10.0 112.022 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.6 mm -115.79 138.23 46.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.917 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.097 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 46.1 tttp -163.96 138.73 4.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -38.91 144.77 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.783 2.989 . . . . 10.0 113.678 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.702 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 37.0 Cg_endo -64.66 154.01 74.53 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.985 2.457 . . . . 10.0 112.785 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.88 126.29 56.1 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.276 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.23 -19.31 63.22 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.272 2.648 . . . . 10.0 112.703 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -35.99 82.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.754 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -130.18 -128.75 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.553 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -156.1 59.76 0.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 10.0 110.441 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.435 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 13.5 tttm -155.66 152.35 28.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.737 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.702 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -74.0 160.04 31.86 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.674 0.273 . . . . 10.0 110.927 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.788 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -102.31 162.69 12.72 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.104 -178.692 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.57 111.45 23.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.699 -0.228 . . . . 10.0 110.874 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.097 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.1 t70 -164.14 -77.57 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.251 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.97 -53.56 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.691 0.62 . . . . 10.0 110.167 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.817 0 CA-C-O 118.301 -0.856 . . . . 10.0 109.691 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.909 0.385 . . . . 10.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -79.39 131.62 36.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.3 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.477 HG11 HD13 ' B' ' 57' ' ' LEU . 90.9 t -118.52 112.99 40.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.184 0.516 . . . . 10.0 110.871 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.692 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 53.7 m-85 -100.2 116.49 32.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.797 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.769 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -129.53 159.62 35.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 10.0 111.763 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 15.6 mtm -125.57 105.33 8.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.811 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.52 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.6 mm -81.15 107.16 13.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -107.39 105.02 14.75 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.553 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 12.8 ttp85 -92.35 74.86 5.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.803 -1.555 . . . . 10.0 106.803 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.637 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.9 t-160 67.29 -82.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.433 -177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -111.29 -10.54 14.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.796 0.332 . . . . 10.0 111.105 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.6 m -92.06 94.95 9.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.565 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.4 m -98.17 112.92 24.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.06 0.457 . . . . 10.0 110.624 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.508 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.0 mt -107.02 119.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -78.33 119.41 21.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.769 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -112.06 118.34 35.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.3 0.571 . . . . 10.0 111.942 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.898 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -103.27 94.81 5.71 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -118.44 -168.57 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.842 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.401 ' O ' HD12 ' B' ' 57' ' ' LEU . 2.2 mmtt -127.17 165.47 19.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -63.36 -22.43 66.87 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.814 0.301 . . . . 10.0 111.814 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 2.7 m -83.1 -8.51 59.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.8 m -77.38 136.77 38.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.077 -0.342 . . . . 10.0 110.077 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 21.1 p -86.14 161.45 18.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.716 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -64.31 -36.53 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.999 0.428 . . . . 10.0 110.337 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -63.99 -30.45 71.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.486 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.69 -35.39 80.62 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.272 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.862 HD11 HD21 ' B' ' 57' ' ' LEU . 47.6 mt -60.95 -42.43 98.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.96 -36.83 82.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.309 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -66.13 -39.16 89.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.949 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -65.73 -48.25 83.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 10.0 109.872 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -63.39 -37.51 79.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.422 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.407 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.4 OUTLIER -59.84 -37.75 80.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.185 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.28 -17.99 79.58 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.938 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.42 -52.15 9.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.983 0.421 . . . . 10.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 34.6 mt -81.44 -17.6 48.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.684 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 63.16 36.47 12.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.802 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -127.87 147.59 63.6 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.76 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.78 130.25 18.77 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.912 3.075 . . . . 10.0 114.134 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 67.4 Cg_endo -76.47 -18.37 15.72 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.846 2.364 . . . . 10.0 111.766 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -65.16 -36.04 82.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.13 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -88.12 0.95 55.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.626 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.22 133.06 34.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.901 0.381 . . . . 10.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.455 ' HB3' ' CE1' ' B' ' 45' ' ' TYR . 83.6 mmt-85 -123.3 110.04 14.7 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 97.2 mt -91.96 116.2 28.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 10.0 111.534 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' B' ' 43' ' ' ARG . 74.8 m-85 -115.19 120.98 41.57 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.02 -0.536 . . . . 10.0 112.027 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.466 ' HB3' HD21 ' B' ' 51' ' ' LEU . 21.0 tttm -121.5 127.26 50.85 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.46 36.98 16.94 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 63.8 20.8 12.39 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.656 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -127.34 146.84 50.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.582 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 tp -79.84 131.67 35.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.341 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' B' ' 46' ' ' LYS . 96.6 mt -76.98 156.33 32.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.885 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -95.56 116.51 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.499 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 50.7 m-20 -59.88 -27.91 67.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.928 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.07 1.5 88.71 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.81 -0.71 . . . . 10.0 113.412 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -113.39 166.3 11.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.583 . . . . 10.0 111.892 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -95.17 171.25 8.85 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.408 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.862 HD21 HD11 ' B' ' 27' ' ' LEU . 77.2 mt -61.83 -40.99 97.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.52 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.32 -30.58 71.5 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.397 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.75 -12.35 59.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.771 0.32 . . . . 10.0 111.352 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' CYS . . . . . 0.446 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 58.3 m -100.69 8.78 43.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.76 0.314 . . . . 10.0 111.556 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.53 1.87 68.22 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.831 -0.7 . . . . 10.0 113.107 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.446 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 82.8 m-85 -79.34 106.98 11.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.813 0.339 . . . . 10.0 110.343 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 1.3 p -137.33 174.41 10.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.138 -0.69 . . . . 10.0 109.138 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.11 -3.55 7.76 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.076 0.465 . . . . 10.0 111.537 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -91.18 -42.81 10.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.165 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.49 -34.16 18.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.762 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.692 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -106.24 107.45 18.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.483 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.512 ' HB2' ' HB3' ' B' ' 71' ' ' ALA . 68.9 mtt180 -120.85 158.5 51.98 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.008 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.504 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 9.7 Cg_endo -53.75 -36.49 82.25 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.132 2.554 . . . . 10.0 113.225 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.524 ' HG3' ' CD1' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.84 13.49 24.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 10.0 111.319 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.512 ' HB3' ' HB2' ' B' ' 68' ' ' ARG . . . -150.99 75.53 8.21 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.442 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.96 136.75 16.84 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.679 2.252 . . . . 10.0 111.284 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 117.22 8.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.699 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 21.7 m -75.17 126.38 30.91 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.334 0.588 . . . . 10.0 111.63 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.52 ' HB ' HD13 ' B' ' 7' ' ' ILE . 33.2 t -122.02 128.19 75.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.164 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.28 126.33 7.36 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' B' ' 9' ' ' ARG . 44.7 tp -104.92 98.78 8.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.918 0.39 . . . . 10.0 111.121 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.38 116.02 28.57 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -95.97 116.8 29.48 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.691 0.281 . . . . 10.0 110.569 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -74.72 109.22 8.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.448 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -130.18 130.64 44.96 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -65.41 136.05 56.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.422 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 20.2 t70 73.1 -7.38 1.51 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.586 -0.734 . . . . 10.0 112.02 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 17.4 m -95.91 100.38 12.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.094 0.473 . . . . 10.0 109.965 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -72.45 -11.32 60.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.191 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.473 ' HG2' HD11 ' B' ' 90' ' ' ILE . 34.6 tt0 -55.66 -31.67 62.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.358 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.964 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.81 -25.53 59.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.842 0.353 . . . . 10.0 111.185 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -87.67 -30.98 19.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.879 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.637 HG12 ' HB2' ' B' ' 10' ' ' HIS . 54.5 mt -78.61 -33.47 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.17 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.48 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 38.0 tt0 -69.46 115.8 36.35 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-O 120.897 0.38 . . . . 10.0 111.677 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.584 ' HA ' ' O ' ' B' ' 95' ' ' SER . 16.3 Cg_exo -69.62 -5.7 16.75 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.471 2.781 . . . . 10.0 112.102 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.48 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 13.8 t80 -68.43 -37.31 80.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.156 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.7 p -108.43 -37.82 5.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.554 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 23.8 m -104.73 141.45 22.57 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.837 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.62 161.78 39.04 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 122.507 2.138 . . . . 10.0 110.719 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.73 135.19 68.28 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.722 2.281 . . . . 10.0 112.398 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -72.79 104.1 3.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 39.4 tp -134.11 121.9 15.9 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.921 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -58.29 127.66 25.63 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.635 2.223 . . . . 10.0 111.665 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.34 -32.83 71.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.362 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.99 -20.23 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.16 0.505 . . . . 10.0 111.192 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 75.3 mmm -113.72 33.16 5.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.846 -0.615 . . . . 10.0 109.638 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.576 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.1 ttpt -97.25 -54.86 0.2 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 113.092 0.775 . . . . 10.0 113.092 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 5.8 Cg_exo -74.09 77.29 2.81 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.554 2.169 . . . . 10.0 112.483 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.592 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.5 mt-30 -139.74 172.37 12.88 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.612 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.453 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 44.9 t0 -89.39 167.38 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.0 m -100.59 135.76 41.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.87 0.367 . . . . 10.0 110.311 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.27 -153.71 12.68 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.792 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.4 p -93.49 -28.71 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 10.0 111.039 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.511 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.2 m -86.04 157.04 20.17 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.616 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.17 122.76 17.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.374 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 72.64 16.7 4.7 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 123.721 0.638 . . . . 10.0 111.791 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.5 tt0 -81.88 126.92 32.47 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -105.54 138.9 40.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.462 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -114.41 106.81 14.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.15 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.592 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -74.34 123.5 29.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.155 179.554 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.236 0.354 0 CA-C-O 120.847 0.356 . . . . 10.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.677 ' HE2' HG12 ' C' ' 4' ' ' ILE . 66.8 tttt -108.43 122.29 46.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 10.0 111.004 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 59.3 mt -99.2 124.99 44.68 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.793 HD11 ' HB3' ' C' ' 41' ' ' GLU . 2.9 mt -108.11 126.52 64.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.3 p -99.46 167.42 10.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.55 -0.295 . . . . 10.0 110.459 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.2 m -66.92 -12.75 60.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 10.0 111.595 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.22 -5.44 59.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.115 0.483 . . . . 10.0 110.266 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.69 16.2 66.42 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.837 -0.697 . . . . 10.0 111.936 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.39 133.22 33.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 10.0 110.573 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.571 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 12.5 mt-10 -100.52 120.82 40.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.761 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.478 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 91.6 m-85 -112.78 114.32 26.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.614 0.245 . . . . 10.0 110.888 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.508 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 25.9 mm -98.2 119.97 46.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 16.8 t -106.28 136.99 38.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.793 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.898 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 55.5 tttt -60.85 128.92 38.87 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.351 -0.386 . . . . 10.0 109.98 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -52.43 -32.89 41.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.394 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.552 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 40.3 tt0 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.629 . . . . 10.0 111.137 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -81.54 -31.11 32.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.154 0.502 . . . . 10.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.14 92.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.737 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 61.7 mt -59.7 -48.99 79.47 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.759 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.563 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -62.79 -42.6 99.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.985 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -62.85 -39.1 93.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.547 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.68 -13.56 82.02 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.525 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 33.1 m -75.36 -26.88 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.218 0.533 . . . . 10.0 110.283 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 18.0 mt -83.49 153.32 3.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -64.67 93.24 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.936 0.398 . . . . 10.0 110.429 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.561 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -99.58 -178.75 3.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.689 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 67.6 mmm -77.58 28.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.641 0.608 . . . . 10.0 112.641 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.85 -28.41 65.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.094 0.473 . . . . 10.0 110.434 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 m -90.39 3.75 52.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.475 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.61 -64.24 3.43 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.695 -0.684 . . . . 10.0 113.461 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.22 175.19 4.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.6 2.2 . . . . 10.0 112.362 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.24 -33.58 64.68 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.293 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -154.47 136.28 14.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.414 . . . . 10.0 110.861 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -118.45 72.48 0.87 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.43 172.71 8.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.365 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -53.17 -31.19 41.4 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.23 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -62.9 -39.67 95.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.038 0.447 . . . . 10.0 110.378 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.543 ' O ' HG22 ' C' ' 42' ' ' VAL . 0.2 OUTLIER -76.54 -29.12 56.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.608 -0.723 . . . . 10.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -73.3 -27.7 61.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.032 0.444 . . . . 10.0 110.562 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -79.14 -57.81 3.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.755 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.793 ' HB3' HD11 ' C' ' 4' ' ' ILE . 28.3 mt-10 -128.61 109.53 11.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.135 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.543 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.6 t -94.2 109.78 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.179 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 13.3 t-20 -90.33 110.85 21.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.914 0.387 . . . . 10.0 110.949 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.591 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.6 m-85 -90.14 125.45 35.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.014 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -99.14 136.6 38.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.344 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 64.33 25.15 13.42 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.686 0.617 . . . . 10.0 111.278 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' C' ' 44' ' ' PHE . 79.1 mt -124.66 103.91 31.16 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.514 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 31.7 Cg_exo -62.04 154.98 58.45 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.289 2.659 . . . . 10.0 112.346 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 13.2 p -65.02 -35.76 82.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -55.4 -57.06 13.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 10.0 112.226 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.463 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.8 m -66.71 -35.76 75.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.388 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 21.4 tp -64.5 -38.95 92.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.742 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 58.9 m -60.74 -41.54 95.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.38 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 54' ' ' LYS . . . . . 0.538 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 54.2 tttp -64.49 -38.33 90.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.624 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' C' ' 51' ' ' VAL . 86.8 t -66.03 -44.76 91.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.074 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.3 m -60.73 -44.33 96.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.803 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.5 mtm -66.62 -36.79 83.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.569 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.559 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.1 t80 -64.7 -41.91 95.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.041 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.428 ' O ' HG23 ' C' ' 63' ' ' VAL . 4.2 m-85 -62.19 -44.72 95.96 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.79 -0.448 . . . . 10.0 109.79 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 24.2 m -60.09 -41.41 92.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.749 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' B' ' 70' ' ' GLN . 20.7 t80 -63.45 -44.69 93.77 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.555 -0.748 . . . . 10.0 109.806 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -63.26 -40.14 96.58 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.371 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.563 HG22 ' HB ' ' C' ' 20' ' ' THR . 49.9 t -59.87 -48.28 88.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.275 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.5 mmt85 -72.67 -38.7 67.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.378 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.444 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 85.4 t80 -57.68 -53.72 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.959 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.2 43.21 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.496 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -155.39 -54.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.174 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.91 -40.12 0.95 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.033 0.444 . . . . 10.0 111.506 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 40.8 m -83.31 53.35 2.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.011 0.434 . . . . 10.0 111.455 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.38 -1.12 45.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.266 0.555 . . . . 10.0 110.342 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 71' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' C' ' 69' ' ' SER . 0.0 OUTLIER -89.55 -22.56 22.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.056 179.705 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.5 pt -90.94 160.98 36.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 72.9 Cg_endo -77.03 176.95 9.49 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.156 1.904 . . . . 10.0 112.819 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -67.12 170.22 7.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.975 -1.011 . . . . 10.0 109.74 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -50.24 130.91 24.52 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.475 -0.329 . . . . 10.0 111.084 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.23 125.11 17.78 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.928 2.419 . . . . 10.0 112.621 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.645 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.5 pt -80.57 52.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.799 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -109.51 -56.34 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.475 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.7 Cg_exo -68.13 106.15 1.31 Allowed 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.968 1.779 . . . . 10.0 112.046 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 37.7 mt-10 -73.46 59.35 0.6 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.105 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 81' ' ' ILE . . . . . 0.659 HD11 ' HA ' ' B' ' 116' ' ' ALA . 10.6 mm -120.48 -7.31 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.573 . . . . 10.0 110.639 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.573 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -67.77 -35.42 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.741 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.557 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 23.9 tp -67.82 -36.15 79.87 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 17.1 mp0 -63.5 -35.75 81.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.116 -0.947 . . . . 10.0 109.64 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.7 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.7 mt -73.56 -35.62 65.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.209 178.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.33 -23.56 67.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.725 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.6 ttp -60.47 -22.04 63.04 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.107 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.52 -34.56 77.13 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.449 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.17 -65.31 0.19 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 124.096 0.873 . . . . 10.0 113.131 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -82.46 55.67 3.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.413 0.625 . . . . 10.0 110.622 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.689 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.3 t80 . . . . . 0 C--O 1.246 0.919 0 CA-C-N 115.163 -0.926 . . . . 10.0 108.75 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.613 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.428 -0.269 . . . . 10.0 112.428 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -66.86 -63.14 1.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -179.044 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.2 tp -61.02 -27.94 68.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.329 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.613 HE21 ' N ' ' A' ' 6' ' ' GLY . 4.5 tt0 -52.6 -34.1 49.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.105 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -106.47 -35.0 7.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.885 0.374 . . . . 10.0 110.648 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.569 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 61.6 mt -59.34 -45.9 90.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.921 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.673 0.273 . . . . 10.0 111.03 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.5 tp -64.22 -37.51 87.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.272 0.558 . . . . 10.0 110.082 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.51 -15.02 53.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.638 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.82 -32.71 31.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.792 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -159.32 114.98 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.618 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 2.0 pt -81.01 94.18 2.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.363 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 79.2 tttt -108.8 95.26 16.37 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.657 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.505 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 1.8 Cg_endo -84.39 78.99 2.66 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.105 2.537 . . . . 10.0 110.936 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 40.1 mttm -130.05 -170.49 2.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.387 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.673 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 49.1 mm-40 -94.16 164.71 12.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.669 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.3 mm -114.56 159.23 14.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.058 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.023 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER 179.92 142.0 0.34 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.794 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 51.0 Cg_exo -40.68 135.47 2.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.243 2.629 . . . . 10.0 112.044 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.761 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 35.9 Cg_endo -63.52 137.15 58.21 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.827 2.351 . . . . 10.0 112.388 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.409 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 94.8 mt -61.01 118.33 34.62 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.069 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 25.4 Cg_endo -61.62 -22.18 73.84 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.053 2.502 . . . . 10.0 112.617 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.03 -14.55 59.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.046 -0.524 . . . . 10.0 111.2 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.407 HG13 ' HB ' ' B' ' 102' ' ' VAL . 0.2 OUTLIER -133.1 -138.63 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.282 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -154.66 49.23 0.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 10.0 110.085 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -149.55 147.93 28.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.445 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -74.28 159.38 32.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.718 0.294 . . . . 10.0 111.158 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.535 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -99.72 169.04 9.53 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.429 -179.426 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.673 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 34.2 tt0 -115.86 120.17 38.36 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.298 -0.26 . . . . 10.0 110.298 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.023 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -162.55 -65.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.127 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.468 ' HA ' ' OE1' ' A' ' 21' ' ' GLN . 0.0 OUTLIER 175.07 -57.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.957 -1.127 . . . . 10.0 107.957 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 114.695 -1.139 . . . . 10.0 109.191 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tmm? . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.692 0.282 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.03 134.52 45.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.373 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.43 120.19 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 121.208 0.528 . . . . 10.0 111.707 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.76 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 69.6 m-85 -109.84 114.71 28.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.199 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.78 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.7 160.95 32.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.843 0.354 . . . . 10.0 111.56 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -129.61 107.2 9.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.011 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.559 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.2 mm -81.91 102.4 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.2 ttt180 -101.18 103.41 14.45 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.408 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.3 ttp85 -88.66 71.26 8.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.622 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.3 t-80 68.02 -81.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.193 -0.912 . . . . 10.0 111.098 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -107.28 -16.32 14.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.903 0.382 . . . . 10.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 0.9 OUTLIER -95.09 97.69 10.11 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.102 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 4.3 m -97.24 115.66 28.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.886 0.374 . . . . 10.0 110.549 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.516 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 54.3 mt -106.92 118.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.105 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -77.93 120.8 23.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.78 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -114.05 121.97 45.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.091 0.472 . . . . 10.0 111.976 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.634 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.5 t70 -107.96 98.25 7.85 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.06 -1.089 . . . . 10.0 108.06 178.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.77 -167.75 1.63 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.324 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -126.22 160.61 29.81 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -60.81 -20.62 61.96 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 12.7 m -86.73 -7.91 57.86 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m -78.11 142.59 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.6 p -90.19 164.06 14.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.787 0.327 . . . . 10.0 110.794 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.4 t -63.26 -39.31 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.369 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -61.59 -32.27 72.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.22 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.96 -38.81 89.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.633 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.727 HD11 HD21 ' B' ' 57' ' ' LEU . 61.8 mt -60.68 -42.42 97.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.033 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -64.84 -35.41 81.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.967 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -66.79 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 77.7 mt -73.18 -46.3 51.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.7 t -61.52 -34.72 62.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.521 179.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.07 -37.38 71.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.864 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.22 -5.71 89.87 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.905 -0.664 . . . . 10.0 113.072 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -105.15 -49.09 9.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.985 0.421 . . . . 10.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.32 -8.54 54.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.412 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 79.0 mttt 56.92 46.48 19.5 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.377 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 1.0 OUTLIER -142.64 143.09 24.8 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.576 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 77.5 Cg_exo -51.84 133.56 45.69 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.438 2.758 . . . . 10.0 113.488 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.94 -16.08 32.63 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.033 2.489 . . . . 10.0 111.957 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.54 -29.05 70.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.434 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -96.09 3.12 53.56 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.946 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.98 132.74 35.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 111.207 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 73.0 mmt-85 -123.86 115.89 22.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.073 178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 83.4 mt -93.41 123.09 36.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.163 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -117.26 119.47 35.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.519 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.486 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.2 tttm -125.1 134.19 52.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 57.74 34.71 24.78 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.296 0.372 . . . . 10.0 110.623 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 65.97 16.14 10.35 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.682 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -123.89 159.76 28.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.825 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.1 tp -87.89 134.32 33.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' B' ' 46' ' ' LYS . 85.8 mt -80.71 152.2 28.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.14 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -92.96 118.47 31.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.143 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 16.3 m-20 -60.25 -26.96 66.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.66 3.74 85.03 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.738 -0.744 . . . . 10.0 113.118 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -108.23 164.99 11.83 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.152 0.501 . . . . 10.0 111.574 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.2 p -96.34 169.71 9.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.675 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.727 HD21 HD11 ' B' ' 27' ' ' LEU . 32.1 mt -62.37 -39.08 92.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.543 -0.298 . . . . 10.0 111.146 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.15 -39.28 94.27 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.031 -0.604 . . . . 10.0 112.594 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -75.02 -24.28 58.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 10.0 110.958 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 63.9 m -85.86 4.44 37.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.766 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.37 14.64 61.61 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.668 -0.777 . . . . 10.0 113.413 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.515 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 57.8 m-85 -87.4 67.23 9.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.968 0.413 . . . . 10.0 110.14 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -95.01 161.89 13.95 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 24.8 m -65.83 -7.63 17.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 10.0 111.56 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -74.71 -48.54 25.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.313 0.578 . . . . 10.0 109.578 178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.03 -40.5 18.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.453 -0.794 . . . . 10.0 109.971 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.76 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -95.46 100.41 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.55 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -115.39 159.42 38.37 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.707 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -58.38 -19.26 42.55 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.881 2.388 . . . . 10.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -116.41 8.25 14.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.061 179.363 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.457 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -153.14 84.51 4.41 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.597 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.561 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.7 Cg_exo -78.31 137.47 15.05 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.844 2.362 . . . . 10.0 111.33 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.12 115.97 9.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.3 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.18 123.32 21.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.441 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.559 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.6 t -122.41 135.58 62.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.49 135.14 12.95 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.684 -0.77 . . . . 10.0 111.695 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.3 tp -116.81 99.92 7.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.96 0.41 . . . . 10.0 111.552 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.87 125.28 37.4 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -106.46 125.36 50.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.699 0.285 . . . . 10.0 110.96 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -75.31 112.18 11.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.061 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.36 139.82 48.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.34 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -77.98 145.1 36.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.392 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 61.14 15.85 6.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.041 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.5 m -127.7 107.99 10.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.638 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -87.25 4.99 40.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.613 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.503 ' O ' HG13 ' B' ' 90' ' ' ILE . 32.7 tt0 -59.9 -28.71 67.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.419 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.57 68.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.02 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.3 mt -71.36 -28.0 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.895 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 19.1 m -80.99 -25.82 36.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.245 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.622 HG12 ' HB2' ' B' ' 10' ' ' HIS . 6.4 mt -91.36 -9.83 10.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.024 0.44 . . . . 10.0 110.817 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 40.4 tt0 -91.45 107.52 22.35 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.641 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 18.1 Cg_exo -68.59 -11.85 33.06 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 10.0 111.582 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -71.23 -38.22 71.98 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.211 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -100.74 -45.75 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.205 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.0 m -106.53 155.35 38.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.771 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 160.81 30.82 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.507 2.138 . . . . 10.0 111.632 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.83 139.85 70.59 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.413 2.075 . . . . 10.0 111.923 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -70.98 96.33 1.29 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.216 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.0 tp -130.46 122.84 20.07 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.95 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.6 Cg_exo -66.01 141.24 63.38 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.902 2.402 . . . . 10.0 111.896 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.79 -35.05 79.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.53 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.407 ' HB ' HG13 ' A' ' 29' ' ' VAL . 12.6 m -68.31 -23.38 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.154 0.502 . . . . 10.0 111.012 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.2 mmm -113.88 59.19 0.67 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.589 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 34.1 ttpt -138.33 -50.88 0.02 OUTLIER Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.565 -0.743 . . . . 10.0 112.269 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 12.5 Cg_exo -73.65 50.6 2.07 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.877 2.385 . . . . 10.0 112.199 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -124.02 160.01 28.6 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.851 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.91 175.5 9.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.894 0.378 . . . . 10.0 111.497 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.9 m -99.82 137.69 37.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.511 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.75 -133.44 2.33 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.432 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.57 -43.3 5.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.037 0.446 . . . . 10.0 111.285 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 15.0 m -81.57 161.23 23.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.271 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 135.59 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.58 0.13 3.55 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.668 0.605 . . . . 10.0 111.391 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.45 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 40.1 tt0 -79.39 115.83 19.26 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.936 0.398 . . . . 10.0 110.421 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -96.98 138.47 34.46 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.069 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.31 108.29 16.73 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.959 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.3 126.57 39.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.372 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.053 179.507 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.966 0.412 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 77.7 tttt -106.39 117.8 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.051 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.539 HD22 ' HE2' ' C' ' 44' ' ' PHE . 24.9 mt -98.44 123.96 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 20.6 mt -111.51 118.57 57.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -93.38 166.59 12.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.439 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -9.79 29.75 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -87.91 4.25 45.49 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.863 0.363 . . . . 10.0 110.652 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.91 23.89 73.49 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.563 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -96.98 128.23 43.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 10.0 110.659 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 13.3 mt-10 -101.08 118.39 36.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.387 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.415 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 90.7 m-85 -109.8 117.27 33.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.767 0.317 . . . . 10.0 111.048 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.516 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -100.22 113.42 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.72 136.54 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.47 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.634 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.8 tttt -59.59 128.61 37.86 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.27 -0.641 . . . . 10.0 109.27 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 25.1 ttt180 -56.38 -28.34 58.92 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -57.19 -51.97 67.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 10.0 110.196 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -73.63 -29.61 62.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.097 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 18' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -65.15 -33.48 76.11 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.073 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 68.5 mt -61.84 -47.46 84.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.231 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.58 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.1 m -66.01 -36.34 83.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.833 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 23.3 m -68.26 -17.93 64.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.441 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -86.55 -16.17 62.5 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.063 -0.815 . . . . 10.0 111.063 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.9 m -83.55 -28.55 28.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.351 0.596 . . . . 10.0 109.639 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.11 141.96 15.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -70.38 88.46 0.65 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.356 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.481 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.06 177.05 5.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.396 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.496 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 89.2 mmm -80.07 36.97 0.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.74 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 tp -68.15 -30.33 69.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.415 0.626 . . . . 10.0 109.368 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.63 15.93 10.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.286 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.91 -64.03 3.36 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.525 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.65 169.5 12.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.565 2.176 . . . . 10.0 111.926 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.96 -52.73 50.48 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.116 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -139.08 116.62 11.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.825 0.345 . . . . 10.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -84.84 93.22 8.45 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.18 165.91 23.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.986 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -59.98 -25.35 65.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.313 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.17 -37.9 88.84 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.5 mp0 -74.27 -30.54 62.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.046 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.69 -22.35 58.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.322 0.582 . . . . 10.0 109.74 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -83.63 -61.88 1.72 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.148 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 42.4 mt-10 -130.8 109.33 10.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.512 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 0.6 OUTLIER -90.7 119.98 38.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.856 -179.078 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -93.61 114.41 26.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.9 0.381 . . . . 10.0 110.689 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.631 ' HB3' HD12 ' C' ' 47' ' ' ILE . 71.7 m-85 -103.95 99.09 8.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.359 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -89.12 147.0 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.053 -0.522 . . . . 10.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 69.75 17.91 7.59 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.698 0.624 . . . . 10.0 111.21 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.631 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.3 mt -124.73 109.52 28.14 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.895 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.91 144.52 99.45 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.048 2.499 . . . . 10.0 112.02 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.4 p -62.12 -36.76 82.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.19 -55.35 32.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.811 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.487 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.7 m -66.27 -36.26 76.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.865 -0.334 . . . . 10.0 111.214 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -63.89 -36.45 83.96 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.329 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -62.37 -41.7 98.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.058 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -66.11 -37.64 86.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.171 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.487 HG23 ' O ' ' C' ' 51' ' ' VAL . 98.7 t -63.59 -44.72 98.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 61.5 m -61.25 -42.7 99.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.433 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.4 mtm -65.15 -37.78 88.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.474 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 86.2 t80 -65.15 -43.76 90.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.403 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.44 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.8 m-85 -61.48 -44.03 97.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.003 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 27.0 m -58.77 -43.31 90.37 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.943 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.417 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 32.8 t80 -65.13 -43.77 90.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.145 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -62.57 -40.4 96.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.293 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.58 HG22 ' HB ' ' C' ' 20' ' ' THR . 44.0 t -58.82 -50.89 77.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.447 . . . . 10.0 109.911 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -69.8 -38.78 76.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.353 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.586 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 44.1 t80 -57.87 -46.35 84.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 10.0 110.822 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.62 18.72 3.78 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.343 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 67' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 12.6 t30 -125.62 -49.5 1.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.868 0.366 . . . . 10.0 111.553 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.72 -31.24 0.39 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.982 0.42 . . . . 10.0 111.774 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.586 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 6.7 m -81.44 31.7 0.34 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.403 0.519 . . . . 10.0 112.403 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.45 -12.63 60.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.339 0.59 . . . . 10.0 110.215 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -77.16 -30.32 54.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.37 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.702 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.7 pt -84.25 165.0 40.98 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.702 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.0 Cg_endo -70.95 167.58 25.57 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.403 2.069 . . . . 10.0 112.872 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -66.4 165.19 14.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.209 -0.905 . . . . 10.0 109.607 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -46.16 126.41 7.3 Favored Pre-proline 0 C--O 1.233 0.223 0 O-C-N 123.56 0.538 . . . . 10.0 111.32 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -51.21 119.72 5.81 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.097 2.532 . . . . 10.0 112.598 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.792 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.8 pt -79.58 47.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.729 -0.668 . . . . 10.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -96.49 -55.87 0.2 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 11.3 Cg_exo -71.15 107.78 2.19 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.032 1.822 . . . . 10.0 111.88 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 1.8 mp0 -76.79 59.87 1.64 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.741 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.3 mm -120.78 -2.66 8.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.268 0.556 . . . . 10.0 110.462 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.472 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -67.7 -34.02 76.06 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.149 -0.344 . . . . 10.0 111.862 -179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 86' ' ' LEU . 28.4 tp -66.11 -35.56 80.82 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.279 0.561 . . . . 10.0 109.797 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.582 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 19.1 mp0 -63.17 -34.4 77.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.254 -0.885 . . . . 10.0 109.717 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 8' ' ' LEU . 82.0 mt -73.82 -31.87 63.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.925 179.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 83' ' ' LEU . 97.1 mt -67.24 -17.05 64.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.055 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.6 ttp -69.46 -13.96 62.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.18 -33.32 74.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.932 -0.396 . . . . 10.0 109.932 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.84 -67.84 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.288 0.847 . . . . 10.0 113.288 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -83.89 42.5 0.86 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 10.0 111.437 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 2.6 t80 . . . . . 0 C--O 1.246 0.873 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.727 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.448 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -57.83 -60.03 4.32 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.205 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.742 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.4 tp -62.91 -29.03 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 10.0 112.012 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.727 HE21 ' N ' ' A' ' 6' ' ' GLY . 0.2 OUTLIER -58.96 -33.37 70.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 10.0 111.125 179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -95.93 -37.79 10.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.454 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 93.1 mt -63.69 -45.9 87.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.425 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.07 -28.25 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 10.0 111.308 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.88 -33.09 75.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 10.0 110.373 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.91 -13.03 40.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.243 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.98 -35.49 23.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.708 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HA ' HG22 ' C' ' 77' ' ' ILE . 9.8 tp -159.62 122.44 3.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.371 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 11.1 mt -89.31 88.11 2.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -99.18 102.86 17.12 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.179 0.437 . . . . 10.0 112.179 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 4.3 Cg_endo -89.48 93.1 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.162 2.575 . . . . 10.0 110.261 178.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -157.2 177.49 11.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.462 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 45.3 mm-40 -87.36 152.38 22.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.96 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.868 HD11 HD23 ' C' ' 83' ' ' LEU . 49.2 mm -118.13 107.14 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.27 -179.108 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.817 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 27.9 tttp -117.68 144.32 34.09 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.721 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 24.4 Cg_exo -32.3 133.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 124.265 3.31 . . . . 10.0 113.742 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.831 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.3 Cg_endo -62.2 138.15 70.4 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 123.105 2.537 . . . . 10.0 112.701 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -72.76 124.79 91.16 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.404 179.45 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.63 -10.36 28.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.218 2.612 . . . . 10.0 112.912 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -36.84 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.861 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 30' ' ' ARG . 3.1 t -129.24 -103.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.399 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG2' HG12 ' A' ' 29' ' ' VAL . 2.0 ptp180 -178.33 63.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.899 0.48 . . . . 10.0 111.112 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -156.09 145.03 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.831 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.5 pp -72.05 149.5 44.81 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.12 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.3 m -84.67 137.7 33.1 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -97.28 80.85 2.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.108 0.48 . . . . 10.0 110.564 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.0 t70 -125.87 -75.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.601 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.85 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.468 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.666 -0.683 . . . . 10.0 109.396 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.433 ' HA ' ' OE1' ' B' ' 20' ' ' GLU . 12.1 mmm . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.666 0.27 . . . . 10.0 111.177 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.82 131.02 3.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.144 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.454 HG11 HD13 ' B' ' 57' ' ' LEU . 47.2 t -134.93 121.8 35.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.962 0.41 . . . . 10.0 111.004 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.92 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 34.4 m-85 -111.26 121.01 44.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.719 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.733 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -135.6 160.19 39.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.811 0.339 . . . . 10.0 111.366 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.635 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 37.3 mtm -126.45 108.42 11.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.043 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.432 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.3 mm -80.44 103.6 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -98.97 102.64 14.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.554 ' HB2' HD23 ' B' ' 77' ' ' LEU . 15.8 ttp85 -90.46 69.59 6.88 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.228 -1.397 . . . . 10.0 107.228 177.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.7 t-160 68.57 -77.05 0.05 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.888 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.441 ' HD2' ' CD2' ' C' ' 9' ' ' HIS . 74.1 mmtt -112.06 -20.9 11.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.892 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -90.5 101.0 13.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.773 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 3.0 m -100.48 117.19 34.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.949 0.404 . . . . 10.0 110.812 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.577 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 56.4 mt -107.27 116.75 51.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.02 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -76.82 118.32 19.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.733 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.4 m -110.31 117.92 34.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.122 0.487 . . . . 10.0 111.529 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 1.019 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -108.73 103.73 12.88 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.131 -1.063 . . . . 10.0 108.131 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -135.05 -159.66 0.98 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.902 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -129.73 167.91 17.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 31.8 mp0 -64.81 -23.55 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.909 0.385 . . . . 10.0 110.793 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -16.76 63.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.547 -0.751 . . . . 10.0 111.798 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' SER . . . . . 0.41 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 7.7 m -78.46 145.54 34.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.746 0.308 . . . . 10.0 110.725 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.7 p -98.39 163.81 12.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.311 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 53.8 t -60.6 -38.09 77.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 110.491 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -61.18 -31.8 71.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.515 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -72.38 -28.12 62.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.772 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.511 HD11 HD21 ' B' ' 57' ' ' LEU . 86.6 mt -65.9 -41.4 91.54 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -60.46 -36.65 78.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.95 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -63.71 -41.01 98.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.144 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -65.77 -47.04 87.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.022 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.32 -40.6 89.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.209 0.528 . . . . 10.0 110.234 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.58 -38.71 92.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.875 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.86 -15.01 66.34 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.735 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.4 mt -103.69 -50.07 9.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 10.0 111.48 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 65.9 mt -83.51 -20.94 33.01 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.635 0.605 . . . . 10.0 112.635 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt 57.77 53.49 7.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.213 0.53 . . . . 10.0 111.61 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 73.4 mtt-85 -139.9 154.51 70.72 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.636 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.48 121.72 6.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.55 2.834 . . . . 10.0 113.766 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.44 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 64.5 Cg_endo -74.28 -18.44 20.68 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.868 2.379 . . . . 10.0 112.645 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -70.49 -25.01 62.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.826 0.346 . . . . 10.0 111.846 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -95.68 3.31 54.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 80.4 mt-30 -84.06 102.53 12.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.783 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.771 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.1 mmt-85 -89.65 97.86 11.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.135 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 87.5 mt -82.11 111.29 18.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.31 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -110.25 115.62 30.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' B' ' 51' ' ' LEU . 45.9 tttm -124.39 137.22 54.48 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.231 -1.026 . . . . 10.0 108.231 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 61.71 26.4 16.06 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.253 0.346 . . . . 10.0 110.329 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 72.66 12.47 5.39 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.159 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -127.05 162.27 26.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.382 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.7 tp -82.35 133.64 35.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.587 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' B' ' 46' ' ' LYS . 74.5 mt -77.94 146.76 35.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.73 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HD2' ' B' ' 55' ' ' LYS . 34.7 t0 -94.49 122.26 36.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 10.0 111.592 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 9.1 m-20 -60.88 -26.79 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.218 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.47 11.98 59.98 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.508 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' B' ' 52' ' ' ASP . 39.8 mttp -126.12 153.86 43.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.005 0.431 . . . . 10.0 111.19 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.8 p -84.45 170.09 13.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.511 HD21 HD11 ' B' ' 27' ' ' LEU . 38.2 mt -61.08 -39.39 89.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.4 -0.363 . . . . 10.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.21 96.21 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.64 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -69.94 -19.14 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.858 0.361 . . . . 10.0 111.332 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.28 10.26 22.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.933 0.397 . . . . 10.0 111.475 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.82 51.49 5.87 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.654 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.542 ' HE1' ' HB3' ' B' ' 73' ' ' ALA . 9.1 m-85 -114.99 78.62 1.18 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.925 0.393 . . . . 10.0 110.486 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -92.21 168.09 11.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -11.41 57.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.14 0.495 . . . . 10.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -83.71 -40.63 18.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.124 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.1 -27.83 26.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.479 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.92 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -114.25 94.85 4.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 55.5 mtt180 -116.04 155.37 48.08 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.769 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.6 -13.39 35.01 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.162 1.908 . . . . 10.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.44 ' OE1' ' HD3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -104.51 -4.96 22.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.948 -1.024 . . . . 10.0 110.056 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.93 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -164.3 93.07 1.01 Allowed Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.965 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.635 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.1 Cg_exo -78.14 140.43 17.74 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.8 2.333 . . . . 10.0 110.914 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' ALA . . . . . 0.542 ' HB3' ' HE1' ' B' ' 62' ' ' PHE . . . -66.61 113.52 4.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 -179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.43 122.97 20.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.813 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.432 ' HB ' HD13 ' B' ' 7' ' ' ILE . 53.9 t -120.23 132.61 69.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 108.655 -0.868 . . . . 10.0 108.655 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.86 131.25 10.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.244 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' B' ' 9' ' ' ARG . 46.4 tp -109.26 97.05 6.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.964 0.411 . . . . 10.0 111.04 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.771 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.78 105.55 17.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.136 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -88.89 105.63 17.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.133 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -77.41 116.93 18.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.318 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -125.06 148.58 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.207 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.85 130.1 42.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.383 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t0 61.9 27.76 16.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.534 0.683 . . . . 10.0 111.382 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 13.6 m -124.16 106.05 10.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.241 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -78.52 -9.63 59.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.859 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 44.6 tt0 -56.28 -38.42 71.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.948 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.62 74.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.916 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.14 -24.57 65.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.471 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 13.9 m -84.17 -21.19 31.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.913 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.5 mt -91.91 -34.45 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.108 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 73.8 tt0 -64.24 115.49 20.04 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.58 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.512 ' HA ' ' O ' ' B' ' 95' ' ' SER . 22.6 Cg_exo -66.87 -11.06 30.61 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.037 2.491 . . . . 10.0 112.15 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -72.8 -25.86 61.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.765 -0.458 . . . . 10.0 109.765 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.63 -51.4 2.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.597 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.512 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 41.9 m -96.55 139.51 21.69 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.396 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.76 166.38 29.03 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.673 2.249 . . . . 10.0 111.181 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.45 115.19 2.3 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.729 2.286 . . . . 10.0 112.281 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -70.31 99.76 1.6 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.931 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 tp -131.83 128.28 21.56 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.336 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.555 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 71.5 Cg_exo -52.06 124.91 15.82 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.034 2.49 . . . . 10.0 112.151 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.58 -38.79 85.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.459 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 m -67.14 -19.0 24.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.188 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.555 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 66.8 mmm -115.71 41.01 2.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.467 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 35.4 tttm -111.65 -53.13 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 8.1 Cg_exo -73.96 66.5 5.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.587 2.191 . . . . 10.0 112.237 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -134.37 173.98 11.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.711 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.44 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.2 t70 -87.18 179.84 6.57 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 9.5 m -108.79 148.33 30.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.262 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' GLY . . . . . 0.43 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -87.75 -150.16 18.82 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.26 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.6 -31.59 15.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.293 0.568 . . . . 10.0 110.458 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.93 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.3 m -96.09 163.78 12.97 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.092 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.18 140.55 54.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.18 -8.14 1.04 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.623 0.577 . . . . 10.0 111.73 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.43 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 37.9 tt0 -75.56 125.89 29.93 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -110.27 156.15 21.08 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.977 0.417 . . . . 10.0 111.143 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.44 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -123.15 103.3 8.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.045 179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.25 126.79 34.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.577 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 C--O 1.237 0.43 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.193 179.459 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.049 0.452 . . . . 10.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 80.2 tttt -109.71 122.58 47.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.575 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 41.1 mt -99.28 132.26 44.73 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.916 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' C' ' 41' ' ' GLU . 11.2 mt -114.51 119.64 62.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.721 0.296 . . . . 10.0 110.22 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 m -85.55 156.52 20.72 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.319 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.7 m -61.82 -25.13 67.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -9.22 58.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.845 0.355 . . . . 10.0 111.263 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.83 28.87 8.02 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.686 -0.768 . . . . 10.0 112.895 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 9' ' ' HIS . . . . . 0.441 ' CD2' ' HD2' ' B' ' 11' ' ' LYS . 8.7 m170 -101.61 145.76 28.62 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.785 -0.244 . . . . 10.0 110.346 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.447 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 21.8 mt-10 -114.74 130.76 56.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.358 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 78.7 m-85 -122.91 118.85 28.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.496 -0.32 . . . . 10.0 110.801 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -102.04 118.58 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 25.3 t -106.84 139.89 26.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 121.229 -0.188 . . . . 10.0 110.77 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 1.019 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 70.4 tttt -60.26 128.5 37.07 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -54.3 -32.85 57.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.983 0.364 . . . . 10.0 111.983 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.498 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 42.3 tt0 -58.34 -37.98 76.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.016 0.436 . . . . 10.0 110.937 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -86.08 -40.17 16.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.178 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.35 90.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.987 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 72.7 mt -59.65 -46.2 89.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.934 0.397 . . . . 10.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -67.81 -32.35 72.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.527 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 25.7 m -69.12 -34.78 75.59 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.1 -10.5 84.18 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.657 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 7.9 m -81.13 -21.49 39.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.92 -0.771 . . . . 10.0 108.92 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -81.28 154.69 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.247 -1.02 . . . . 10.0 108.247 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -73.53 82.59 1.49 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.992 0.425 . . . . 10.0 110.732 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -91.52 170.06 10.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.955 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.692 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 82.6 mmm -78.89 45.13 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.527 0.565 . . . . 10.0 112.527 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.87 -26.47 62.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.273 0.559 . . . . 10.0 109.554 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.76 6.05 37.01 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.346 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.03 -58.44 14.52 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.432 -0.804 . . . . 10.0 113.338 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.47 -175.48 1.58 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.264 1.976 . . . . 10.0 111.899 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.62 -58.71 5.68 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.69 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -137.23 118.32 14.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.69 0.281 . . . . 10.0 110.282 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -79.79 83.18 5.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.148 0.499 . . . . 10.0 110.049 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.94 158.57 34.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.197 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.9 -27.67 60.98 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.752 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -60.37 -45.24 94.22 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.542 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.3 tp10 -74.29 -28.91 61.41 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.523 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -67.48 -26.25 66.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 10.0 110.789 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -89.98 -57.63 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.687 ' HB3' HD11 ' C' ' 4' ' ' ILE . 19.4 mt-10 -119.44 93.22 4.0 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.791 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -80.54 108.53 14.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.125 -178.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 43' ' ' ASN . . . . . 0.54 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 27.2 t-20 -92.57 118.25 30.81 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.761 0.315 . . . . 10.0 110.246 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.586 ' HB3' HD12 ' C' ' 47' ' ' ILE . 91.7 m-85 -95.33 138.99 32.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 10.0 111.953 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 mmt85 -105.48 135.37 47.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.123 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 62.04 27.46 16.6 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.722 0.638 . . . . 10.0 111.796 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.586 HD12 ' HB3' ' C' ' 44' ' ' PHE . 81.6 mt -124.56 107.06 29.53 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-O 121.072 0.463 . . . . 10.0 111.02 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.445 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 16.5 Cg_exo -70.84 138.38 34.26 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.204 2.603 . . . . 10.0 111.913 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 49' ' ' SER . . . . . 0.437 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 0.9 OUTLIER -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.97 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -34.17 71.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.06 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.524 ' HB ' HD21 ' C' ' 85' ' ' LEU . 17.4 m -93.59 -27.89 4.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.676 -0.41 . . . . 10.0 110.586 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -67.39 -34.0 76.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.951 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.93 -40.27 92.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.052 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -65.49 -35.38 80.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.403 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.16 -42.98 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 47.1 m -62.86 -41.48 99.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.352 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 60.9 mtm -66.49 -37.14 84.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.614 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.581 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -64.02 -44.1 93.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.165 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.431 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.2 m-85 -61.88 -44.24 97.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.281 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 30.1 m -60.62 -42.54 97.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.836 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -65.19 -42.04 93.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.997 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 20.9 tptt -62.79 -42.62 99.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.523 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 59' ' ' PHE . 68.3 t -60.03 -46.21 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.605 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.4 mmt85 -72.4 -38.47 68.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.958 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.879 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 74.6 t80 -59.8 -55.34 35.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.134 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 51.94 1.83 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.989 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -170.14 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.309 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.77 -38.27 1.01 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.326 0.491 . . . . 10.0 112.326 -178.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.879 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.3 m -83.75 28.44 0.58 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.919 0.39 . . . . 10.0 111.78 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.48 -12.96 61.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.844 0.354 . . . . 10.0 111.0 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -82.74 -20.42 36.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.73 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.738 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.42 169.08 8.6 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.758 -0.201 . . . . 10.0 110.463 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.738 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 71.9 Cg_endo -77.98 173.32 14.17 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.272 1.982 . . . . 10.0 113.002 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.557 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 15.4 tp10 -70.12 177.69 3.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.692 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.557 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 5.2 t80 -53.94 127.35 53.46 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -54.4 120.26 7.73 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.76 2.307 . . . . 10.0 112.315 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.735 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.5 pt -76.16 55.93 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.396 0.617 . . . . 10.0 110.917 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.669 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.28 -56.69 0.11 Allowed Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.834 -0.621 . . . . 10.0 112.187 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.669 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.9 Cg_exo -68.19 121.01 7.97 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.691 1.594 . . . . 10.0 110.529 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -77.62 29.02 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 46.9 mm -116.71 96.71 4.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.121 -0.696 . . . . 10.0 109.121 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.14 -40.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.431 -0.804 . . . . 10.0 109.605 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.868 HD23 HD11 ' A' ' 22' ' ' ILE . 4.4 tp -67.56 -22.77 65.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.617 -0.882 . . . . 10.0 108.617 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.701 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 31.9 mp0 -64.83 -32.76 74.6 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.812 -1.085 . . . . 10.0 109.164 177.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.742 ' HB3' HD21 ' A' ' 8' ' ' LEU . 64.9 mt -80.44 -33.55 36.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.297 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.484 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.6 tt -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.104 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 87' ' ' MET . . . . . 0.456 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 36.2 ttp -63.61 -16.79 61.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.28 69.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.093 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.51 -68.65 0.17 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.053 0.76 . . . . 10.0 113.053 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -82.04 45.8 0.95 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 10.0 111.342 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.244 0.809 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 179.614 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 120.719 0.066 . . . . 10.0 112.962 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -68.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.324 0.861 . . . . 10.0 113.324 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.841 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.1 tp -61.6 -29.14 69.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.351 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.54 -31.41 46.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.116 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -105.07 -42.9 5.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.383 179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.547 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 82.5 mt -57.88 -41.44 82.51 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.26 70.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.729 0.3 . . . . 10.0 111.788 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 tp -67.75 -31.01 70.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 10.0 111.379 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.3 11.02 7.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.173 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.51 -52.6 1.6 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.011 0.434 . . . . 10.0 110.572 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' C' ' 77' ' ' ILE . 5.3 mt -131.56 94.36 3.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.341 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.425 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.9 mt -73.76 100.83 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.885 0.374 . . . . 10.0 110.544 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.701 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 83.6 tttt -103.69 101.8 26.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.59 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 83.7 Cg_endo -90.3 58.75 1.57 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.988 2.458 . . . . 10.0 111.91 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.701 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 30.4 mttm -110.02 -170.53 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.54 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.813 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 35.7 mm-40 -87.51 163.45 16.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.1 mm -112.61 144.84 19.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.669 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.034 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -172.33 138.85 0.97 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.006 -0.738 . . . . 10.0 109.006 179.309 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.742 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 71.4 Cg_exo -42.74 140.13 3.0 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.198 2.598 . . . . 10.0 112.423 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.64 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 44.8 Cg_endo -67.14 134.52 34.23 Favored 'Trans proline' 0 N--CA 1.465 -0.147 0 C-N-CA 122.846 2.364 . . . . 10.0 112.229 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.597 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.5 OUTLIER -75.97 119.24 76.32 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.367 179.182 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 18.3 Cg_endo -60.27 -15.28 33.96 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.286 2.657 . . . . 10.0 113.305 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -32.41 73.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.251 0.548 . . . . 10.0 109.638 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.843 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -128.42 -127.24 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.434 -0.803 . . . . 10.0 108.861 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -163.45 61.21 0.17 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.446 0.641 . . . . 10.0 110.223 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 12.1 tttm -157.03 150.69 24.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.086 -0.961 . . . . 10.0 108.815 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.64 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.9 pp -73.9 150.56 40.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.782 0.325 . . . . 10.0 110.751 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.5 m -88.06 169.51 11.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.824 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.813 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 17.5 tt0 -116.77 121.97 43.1 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.975 -0.379 . . . . 10.0 109.975 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.034 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.0 t70 -166.9 -75.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.252 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 170.96 -47.48 0.01 OUTLIER 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.322 -179.803 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.1 tmm? . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.866 0.365 . . . . 10.0 110.526 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.67 138.71 50.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.141 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.0 t -131.04 120.17 46.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.152 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.526 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.2 m-85 -109.48 120.71 43.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.472 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.757 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -131.69 159.33 38.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.8 0.333 . . . . 10.0 111.341 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -128.74 109.54 11.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.77 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 38.7 mm -82.05 105.19 11.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -104.87 104.58 14.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.07 0.767 . . . . 10.0 113.07 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.409 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 18.3 ttp85 -93.68 81.34 4.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.215 -1.402 . . . . 10.0 107.215 177.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.452 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.4 t-160 65.52 -85.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.353 -178.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -112.69 -13.34 13.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.137 0.494 . . . . 10.0 111.222 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.9 m -90.19 103.12 15.83 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -104.13 123.71 47.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.743 0.306 . . . . 10.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.596 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 66.1 mt -113.85 118.42 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.751 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' PHE . . . . . 0.433 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 68.2 t80 -79.54 121.54 25.36 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 178.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.757 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -114.73 122.28 45.93 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.245 0.545 . . . . 10.0 111.969 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.818 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -104.97 102.91 12.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.016 -1.105 . . . . 10.0 108.016 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.51 -166.33 1.62 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.952 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -134.9 161.25 35.76 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 6.8 mp0 -58.27 -28.99 65.45 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -10.97 60.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.1 m -85.67 147.1 26.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.388 -0.227 . . . . 10.0 110.388 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.4 p -91.67 164.14 13.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.747 0.308 . . . . 10.0 111.05 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.477 HG11 ' HB3' ' B' ' 51' ' ' LEU . 7.4 t -67.5 -32.67 58.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 10.0 110.179 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -62.09 -35.97 80.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.343 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.58 -35.41 79.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.883 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.64 HD11 HD21 ' B' ' 57' ' ' LEU . 73.7 mt -61.33 -40.82 95.64 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.051 0.453 . . . . 10.0 109.859 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -63.21 -35.36 80.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.082 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -69.46 -33.78 73.42 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.802 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' B' ' 27' ' ' LEU . 96.1 mt -67.62 -44.32 86.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 85.9 t -63.83 -36.1 75.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.32 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 30.5 tt0 -61.76 -37.28 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.815 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.36 -13.36 79.89 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.7 -0.762 . . . . 10.0 112.531 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -104.32 -56.09 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 10.0 111.73 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.72 -11.52 58.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.706 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 96.0 mttt 58.72 42.93 19.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.85 -0.614 . . . . 10.0 112.455 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' B' ' 37' ' ' ARG . 48.4 mtt-85 -129.71 141.47 41.93 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.172 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -53.67 130.97 41.57 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.145 2.563 . . . . 10.0 113.104 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.06 -13.65 34.18 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.98 2.453 . . . . 10.0 112.473 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.47 -37.33 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.413 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -96.22 9.56 40.65 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.42 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -90.08 126.49 35.8 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.775 0.321 . . . . 10.0 111.091 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 81.1 mmt-85 -119.7 113.15 20.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' B' ' 51' ' ' LEU . 94.9 mt -94.09 130.13 40.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.954 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -123.01 122.38 38.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.351 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.459 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.1 tttm -124.66 133.95 53.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.18 37.74 23.82 Favored 'General case' 0 C--O 1.234 0.27 0 O-C-N 123.458 0.474 . . . . 10.0 111.543 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 64.9 18.37 11.45 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.43 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -129.17 155.31 45.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.176 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 63.7 tp -76.09 138.51 40.84 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.924 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.477 ' HB3' HG11 ' B' ' 24' ' ' VAL . 33.9 mt -89.49 158.51 17.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.645 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' B' ' 53' ' ' ASP . 8.8 t70 -80.36 -160.85 0.32 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.465 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.467 ' H ' ' CG ' ' B' ' 52' ' ' ASP . 1.0 OUTLIER -135.05 -57.05 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.013 0.435 . . . . 10.0 110.322 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.79 -23.35 64.51 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.645 -0.707 . . . . 10.0 113.087 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -69.71 154.66 41.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.784 0.325 . . . . 10.0 110.581 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 40.9 p -86.97 166.79 14.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.238 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.64 HD21 HD11 ' B' ' 27' ' ' LEU . 36.5 mt -60.97 -40.81 94.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.833 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.81 -28.4 65.7 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.92 -0.657 . . . . 10.0 112.587 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -84.43 -11.58 55.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.803 0.335 . . . . 10.0 111.309 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 38.9 m -103.77 11.88 35.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.058 0.456 . . . . 10.0 111.915 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.04 8.11 69.43 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.337 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 63.2 m-85 -87.86 90.48 8.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.579 -0.365 . . . . 10.0 110.625 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -122.88 167.93 12.92 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.6 m -67.46 -4.43 11.32 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -89.52 -44.62 9.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.98 -33.94 26.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.248 0.547 . . . . 10.0 109.755 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.526 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -107.18 100.58 10.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.295 -0.866 . . . . 10.0 109.196 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -109.9 158.01 36.14 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.959 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.07 -18.5 63.82 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.439 2.093 . . . . 10.0 111.502 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 11.6 pt20 -107.56 4.69 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.362 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.568 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -163.62 86.97 1.24 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.782 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.572 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.4 Cg_exo -76.27 146.05 27.89 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.829 2.353 . . . . 10.0 111.332 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 117.01 15.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.109 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.3 m -72.84 126.14 29.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.168 0.509 . . . . 10.0 111.656 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.7 t -123.2 133.19 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.01 134.49 12.67 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.695 -0.764 . . . . 10.0 111.759 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.43 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 48.2 tp -110.88 101.75 10.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.888 0.375 . . . . 10.0 111.167 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.08 101.27 12.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -83.96 113.92 21.33 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.714 -0.476 . . . . 10.0 109.714 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -72.3 94.49 1.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.499 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -111.77 120.42 41.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.955 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.03 144.17 55.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.863 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.08 -5.05 2.02 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.737 0.648 . . . . 10.0 111.985 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m -111.98 104.72 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.012 0.434 . . . . 10.0 110.2 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -76.52 -7.92 56.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.87 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.46 ' O ' HG13 ' B' ' 90' ' ' ILE . 47.9 tt0 -56.97 -32.96 66.6 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.025 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.08 74.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.852 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.74 -29.68 68.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.665 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 21.3 m -78.9 -21.62 47.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.398 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.46 HG13 ' O ' ' B' ' 86' ' ' GLU . 27.1 mt -89.22 -18.61 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.25 0.548 . . . . 10.0 109.927 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.665 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 37.3 tt0 -80.68 111.93 27.31 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.203 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.632 ' HA ' ' O ' ' B' ' 95' ' ' SER . 67.9 Cg_endo -75.48 10.82 1.74 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.935 2.424 . . . . 10.0 112.111 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.665 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 45.2 t80 -91.78 -31.88 15.59 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 13.2 m -116.04 -16.36 11.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.323 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.632 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.1 m -128.28 147.26 62.89 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.249 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -73.78 156.77 48.44 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.444 2.096 . . . . 10.0 111.65 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.1 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.548 2.165 . . . . 10.0 111.706 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -59.23 114.98 2.9 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.433 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 22.3 tp -138.92 129.69 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.613 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.6 Cg_exo -60.65 130.32 32.88 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.768 2.312 . . . . 10.0 111.357 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.08 -35.46 80.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.95 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.843 ' HB ' HG13 ' A' ' 29' ' ' VAL . 22.3 m -67.97 -17.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.602 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 90.7 mmm -114.2 13.29 17.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.887 0.375 . . . . 10.0 110.746 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -82.12 -50.04 0.85 Allowed Pre-proline 0 CA--C 1.541 0.61 0 N-CA-C 113.198 0.814 . . . . 10.0 113.198 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -76.92 61.47 7.12 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.128 1.885 . . . . 10.0 112.447 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 59.2 mt-30 -130.55 150.53 51.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.536 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.429 ' H ' HE22 ' B' ' 118' ' ' GLN . 0.2 OUTLIER -77.87 158.32 29.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.441 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 37.9 m -73.16 138.6 45.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.374 -0.375 . . . . 10.0 110.407 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.72 -118.07 2.27 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.919 -0.658 . . . . 10.0 112.467 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -114.97 -46.29 2.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.986 0.422 . . . . 10.0 111.059 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 17.5 m -70.87 165.93 22.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.234 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' ALA . . . . . 0.568 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.79 120.12 13.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.197 -0.456 . . . . 10.0 109.799 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.2 t30 68.81 31.09 4.54 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.735 0.647 . . . . 10.0 111.014 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -87.1 135.64 33.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.098 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -114.85 127.24 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.036 0.446 . . . . 10.0 111.38 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -100.91 115.32 30.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.539 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.489 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 1.8 t -73.29 118.08 18.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.415 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.429 HE22 ' H ' ' B' ' 107' ' ' ASP . 1.6 mp0 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.778 0.323 . . . . 10.0 110.929 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' C' ' 41' ' ' GLU . 32.9 ttpt -112.44 117.5 32.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.886 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.7 mt -89.21 135.57 33.5 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.433 HD11 ' HB3' ' C' ' 41' ' ' GLU . 35.9 mt -116.5 121.31 67.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 120.845 0.355 . . . . 10.0 110.64 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.85 165.85 13.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.117 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 14.4 m -64.24 -26.6 68.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.688 0.28 . . . . 10.0 111.646 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 7' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' C' ' 48' ' ' PRO . 14.2 m-20 -75.4 -3.21 32.43 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.149 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.95 10.56 66.44 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.122 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 9' ' ' HIS . . . . . 0.452 ' HB2' ' HB3' ' C' ' 49' ' ' SER . 0.2 OUTLIER -79.29 139.9 37.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.833 0.349 . . . . 10.0 110.561 179.863 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.7 mt-10 -111.79 133.78 53.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.679 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.448 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 85.8 m-85 -124.81 111.03 15.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.866 0.365 . . . . 10.0 111.687 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 11.2 mm -93.31 115.77 32.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 15.9 t -102.06 142.09 17.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.502 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.818 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 67.5 tttt -62.21 130.89 47.48 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.756 -0.461 . . . . 10.0 109.756 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 49.0 ttt180 -48.17 -42.26 29.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 112.176 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.411 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 48.5 tt0 -56.54 -49.19 75.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.965 0.412 . . . . 10.0 111.385 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -68.91 -36.17 77.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.951 0.405 . . . . 10.0 110.397 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.5 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.365 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 88.8 mt -60.6 -47.96 83.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.03 0.443 . . . . 10.0 110.832 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.566 ' HB ' HG22 ' C' ' 63' ' ' VAL . 2.2 m -62.85 -45.86 90.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.54 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 15.7 m -65.77 -24.37 66.93 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.056 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.78 -6.55 86.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.042 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 41.2 m -88.05 -28.19 21.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.287 0.565 . . . . 10.0 109.855 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -78.11 150.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.241 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.42 96.9 0.26 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.161 0.505 . . . . 10.0 110.652 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -103.67 176.21 5.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.019 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.631 ' SD ' ' HA3' ' C' ' 30' ' ' GLY . 1.1 tmm? -83.79 31.43 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.57 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.91 -29.84 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.386 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.8 p -90.57 -0.52 57.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.341 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 30' ' ' GLY . . . . . 0.631 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . -70.39 -56.02 8.15 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-N 115.65 -0.705 . . . . 10.0 114.576 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 31' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 25.0 Cg_endo -60.72 -13.02 24.01 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.988 2.459 . . . . 10.0 114.002 -179.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 124.85 -112.05 1.67 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.766 -0.73 . . . . 10.0 111.961 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -100.22 109.88 22.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.94 0.4 . . . . 10.0 110.038 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -86.55 103.84 15.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.818 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.37 167.29 9.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.408 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -52.77 -27.16 16.68 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -57.93 -33.75 69.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.04 0.448 . . . . 10.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -97.77 -24.92 15.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.264 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -64.69 -33.78 76.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.56 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -70.32 -52.54 22.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.176 0.512 . . . . 10.0 109.93 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' C' ' 2' ' ' LYS . 52.3 mt-10 -133.9 100.57 4.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.406 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 t -80.38 108.22 13.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.19 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -89.44 124.05 34.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.15 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.595 ' HB3' HD12 ' C' ' 47' ' ' ILE . 82.6 m-85 -104.77 128.62 52.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.688 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 45' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' C' ' 45' ' ' ARG . 8.1 mmt180 -101.48 140.69 35.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.006 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 60.11 31.45 20.57 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.304 0.573 . . . . 10.0 111.545 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.595 HD12 ' HB3' ' C' ' 44' ' ' PHE . 92.2 mt -131.21 110.79 15.36 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.499 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.535 ' HA ' ' OD2' ' C' ' 7' ' ' ASP . 17.8 Cg_exo -68.88 149.49 72.47 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 123.08 2.52 . . . . 10.0 111.925 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 49' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 1.8 p -65.6 -31.71 72.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.749 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -56.27 -54.4 45.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.631 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.58 -33.61 57.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.767 0.318 . . . . 10.0 111.112 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -64.81 -32.97 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.884 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 56.2 m -59.98 -40.63 89.81 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.806 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -68.01 -35.1 77.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.382 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 44.6 t -66.41 -43.8 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.046 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.418 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 69.9 mtm -67.04 -36.45 82.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.229 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.547 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 83.6 t80 -63.83 -42.61 97.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 7.1 m-85 -60.79 -46.21 91.37 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.622 178.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -58.13 -43.31 87.19 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.451 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 26.5 t80 -66.41 -45.53 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.473 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 tptt -62.5 -40.89 98.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.419 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.566 HG22 ' HB ' ' C' ' 20' ' ' THR . 41.5 t -58.45 -44.75 89.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.161 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 64' ' ' ARG . 12.2 mmt85 -74.37 -43.74 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.597 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.523 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 47.1 t80 -54.45 -43.47 71.65 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.905 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.93 14.71 13.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.082 0.468 . . . . 10.0 111.808 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -123.44 -62.28 1.33 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.94 0.348 . . . . 10.0 111.94 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 4.7 m -148.83 38.58 0.83 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.092 0.472 . . . . 10.0 110.711 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.523 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 19.7 m -147.75 36.0 0.86 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.17 0.51 . . . . 10.0 110.57 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.07 0.93 55.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.435 0.636 . . . . 10.0 110.108 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -75.91 -29.58 58.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.609 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 pt -94.9 159.53 33.0 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.681 -0.691 . . . . 10.0 109.247 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.81 -175.6 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.452 2.101 . . . . 10.0 112.509 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 12.0 tp10 -68.76 175.91 3.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.248 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.445 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 32.5 t80 -52.4 130.59 43.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.508 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.31 116.34 2.77 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.099 2.532 . . . . 10.0 111.813 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.78 ' HA ' HD23 ' A' ' 16' ' ' LEU . 10.2 mt -78.06 72.2 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.395 0.617 . . . . 10.0 111.272 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -120.4 -59.65 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.287 -0.869 . . . . 10.0 111.419 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.569 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 72.3 Cg_endo -77.71 102.78 1.63 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.597 1.531 . . . . 10.0 111.28 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.51 69.89 2.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.968 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -119.15 10.62 6.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.426 0.631 . . . . 10.0 110.08 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.702 ' HB2' ' HB2' ' A' ' 16' ' ' LEU . . . -73.35 -35.51 65.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.15 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.545 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 19.7 tp -66.0 -34.96 79.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.416 ' HA ' HD23 ' A' ' 32' ' ' LEU . 19.5 mp0 -64.13 -33.7 76.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.592 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.841 ' HB3' HD21 ' A' ' 8' ' ' LEU . 90.1 mt -77.2 -34.15 56.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.715 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.2 -12.13 61.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.768 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 47.7 ttp -62.71 -17.42 60.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 10.0 111.465 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.7 -9.75 58.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.781 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.91 -80.62 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 O-C-N 123.826 0.704 . . . . 10.0 112.421 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -101.8 83.7 2.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.522 0.677 . . . . 10.0 111.84 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.317 -0.843 0 N-CA-C 107.626 -1.25 . . . . 10.0 107.626 178.558 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.455 ' HA2' ' OE1' ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 112.779 -0.128 . . . . 10.0 112.779 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -67.78 -59.66 3.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.769 0.285 . . . . 10.0 111.414 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 15.5 tp -63.85 -24.05 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.053 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.455 ' OE1' ' HA2' ' A' ' 6' ' ' GLY . 60.4 mt-30 -54.81 -46.31 74.51 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.007 0.432 . . . . 10.0 110.399 178.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -88.97 -33.66 17.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.504 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 63.7 mt -59.66 -42.54 93.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.76 -40.52 79.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.899 0.38 . . . . 10.0 110.626 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.4 tp -66.72 -32.29 73.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.268 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.75 -3.43 56.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.607 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.3 -34.01 9.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.068 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.656 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.8 OUTLIER -161.75 118.19 2.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.015 179.667 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 4.4 mp -81.8 94.13 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 178.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 22.1 tttt -102.04 104.72 38.03 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 18.5 Cg_endo -93.81 68.95 0.41 Allowed 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.336 2.691 . . . . 10.0 110.214 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -120.93 -175.66 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.129 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -90.62 155.43 18.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.512 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.7 mm -118.3 126.95 75.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.058 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -145.66 141.45 16.86 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.508 -0.923 . . . . 10.0 108.508 179.339 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.436 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 29.5 Cg_exo -34.07 129.04 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.879 3.053 . . . . 10.0 113.143 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.744 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.3 Cg_endo -57.01 134.62 65.74 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.21 2.607 . . . . 10.0 112.566 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.482 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -73.64 125.96 90.11 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.034 179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -68.91 -12.22 33.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.95 2.433 . . . . 10.0 112.179 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -36.84 84.83 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.849 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -126.58 -114.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.13 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.432 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.4 ptp180 -168.44 53.64 0.05 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.085 0.469 . . . . 10.0 110.958 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.7 tttm -151.17 152.01 32.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.622 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.744 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -73.96 150.94 40.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.719 0.295 . . . . 10.0 110.708 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.602 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.2 m -92.9 169.58 10.34 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.343 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.402 ' H ' HG22 ' A' ' 33' ' ' THR . 19.0 mt-10 -120.12 123.4 43.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 10.0 110.408 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.981 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.5 OUTLIER -163.84 -70.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.666 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.0 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.545 -0.909 . . . . 10.0 108.545 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.125 -0.943 . . . . 10.0 109.09 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.777 0.322 . . . . 10.0 111.259 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -107.98 133.91 51.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 10.0 111.776 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 86.8 t -122.48 116.47 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.422 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 47.1 m-85 -102.82 118.27 36.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.545 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.715 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -129.31 158.47 39.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.919 0.39 . . . . 10.0 111.501 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 2.0 mtm -127.49 108.08 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.5 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.568 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -81.07 113.43 20.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -109.97 107.03 16.79 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.721 0.637 . . . . 10.0 112.721 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.573 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 25.7 ttp85 -96.97 74.29 2.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 177.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.64 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.7 t-160 68.31 -82.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.267 -177.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -115.61 -9.37 12.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.963 0.411 . . . . 10.0 110.928 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 7.2 m -93.15 98.66 11.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.82 128.73 44.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.694 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.602 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 69.3 mt -123.42 118.54 54.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.79 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -79.05 124.03 27.89 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.715 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -117.72 125.19 50.2 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.144 0.497 . . . . 10.0 111.707 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.419 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.2 t70 -108.73 99.68 9.01 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.01 -164.26 1.1 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.495 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm -130.22 165.36 22.56 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.422 ' O ' ' HB ' ' B' ' 56' ' ' THR . 25.0 mp0 -62.54 -29.53 70.63 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 57.7 m -78.43 -7.62 57.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 15.3 m -76.85 130.27 37.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 36.6 p -82.9 162.34 21.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.72 0.295 . . . . 10.0 110.769 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.824 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 78.1 t -63.94 -32.39 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.91 0.386 . . . . 10.0 110.451 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.38 -32.84 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.209 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.56 -33.51 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.435 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.731 HD11 HD21 ' B' ' 57' ' ' LEU . 91.9 mt -61.63 -46.0 91.68 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -61.82 -35.5 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.453 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.3 mtp180 -63.24 -38.21 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 10.0 109.998 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.1 -45.21 80.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.791 -0.641 . . . . 10.0 110.065 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.86 -38.57 82.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.419 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.834 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 3.8 tm-20 -58.93 -37.89 77.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.538 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.51 1.13 83.46 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.966 -0.561 . . . . 10.0 113.028 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 98.9 mt -113.52 -55.13 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.859 0.361 . . . . 10.0 110.772 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.09 -12.32 57.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.543 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt 58.48 49.98 9.92 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.91 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' B' ' 37' ' ' ARG . 57.1 mtt-85 -138.94 143.67 38.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.166 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.31 124.26 11.54 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.355 2.703 . . . . 10.0 113.069 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.834 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.2 Cg_endo -72.52 -16.52 27.21 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.804 2.336 . . . . 10.0 111.156 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.42 -29.11 69.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.011 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -98.29 5.49 48.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.893 0.378 . . . . 10.0 111.437 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -88.37 133.21 34.15 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.519 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.413 ' HD3' HH11 ' B' ' 43' ' ' ARG . 49.3 mmt-85 -119.65 114.88 22.87 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.53 120.88 37.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.618 -0.265 . . . . 10.0 110.382 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 83.6 m-85 -117.29 130.41 56.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.509 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 43.5 tttm -135.06 133.97 39.88 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 62.83 29.73 16.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.397 0.436 . . . . 10.0 110.57 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 72.23 6.17 5.47 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.309 -0.859 . . . . 10.0 111.852 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -120.77 161.77 20.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.1 tp -77.85 145.04 36.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.844 0.354 . . . . 10.0 111.319 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 34.9 mt -87.69 151.43 22.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.932 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -97.07 108.51 21.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.124 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.824 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.5 m-20 -51.06 -44.34 61.14 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 113.337 0.865 . . . . 10.0 113.337 -178.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -70.58 -7.16 60.56 Favored Glycine 0 CA--C 1.518 0.245 0 CA-C-N 116.13 -0.486 . . . . 10.0 114.226 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -102.6 162.18 13.13 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 117.107 0.453 . . . . 10.0 111.106 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 38.2 p -90.73 167.23 12.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.081 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.731 HD21 HD11 ' B' ' 27' ' ' LEU . 33.7 mt -59.93 -40.95 90.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.621 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.54 -37.23 88.21 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.055 -0.593 . . . . 10.0 112.201 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.96 -9.85 59.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.647 0.26 . . . . 10.0 111.512 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.6 m -102.71 8.66 39.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.987 0.422 . . . . 10.0 111.036 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.95 65.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.29 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.509 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 31.2 m-85 -87.08 76.79 9.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.94 0.4 . . . . 10.0 110.334 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.23 155.56 17.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.165 -0.471 . . . . 10.0 109.762 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 5.1 m -66.08 -11.97 52.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 10.0 111.376 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -75.76 -28.36 58.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.018 0.437 . . . . 10.0 110.465 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.25 -48.49 4.37 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -89.08 82.02 6.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.204 -0.907 . . . . 10.0 109.307 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.425 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 53.8 mtt180 -94.4 158.88 34.97 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.963 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 21.5 Cg_endo -62.95 -16.08 51.8 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.537 2.158 . . . . 10.0 111.925 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -105.69 2.92 28.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.411 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.83 82.98 2.01 Favored Pre-proline 0 C--O 1.233 0.235 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.878 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.41 132.57 25.93 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.712 2.275 . . . . 10.0 111.473 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.54 119.53 8.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.784 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.93 124.45 26.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.928 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.568 ' HB ' HD13 ' B' ' 7' ' ' ILE . 25.5 t -123.0 130.89 74.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.53 131.19 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.709 -0.758 . . . . 10.0 111.924 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.4 tp -113.9 110.75 20.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.422 . . . . 10.0 111.363 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -106.79 124.38 49.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.683 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -105.41 114.08 28.04 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 -71.64 113.53 8.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.031 0.443 . . . . 10.0 111.243 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.563 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -127.73 130.1 48.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.563 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -59.95 134.9 57.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.409 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.7 t70 71.27 -10.44 0.79 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.336 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.563 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 5.0 m -100.03 100.39 11.26 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.167 0.508 . . . . 10.0 110.276 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -77.21 1.13 19.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.7 -0.682 . . . . 10.0 112.28 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.29 -33.01 68.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.943 0.401 . . . . 10.0 110.27 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.14 82.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.238 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 91.0 mt -75.32 -7.09 53.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.567 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 18.6 m -96.85 -27.88 14.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.061 0.458 . . . . 10.0 110.344 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.2 mt -88.07 -31.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.481 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.417 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 39.1 tt0 -64.27 114.65 14.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.573 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.606 ' HA ' ' O ' ' B' ' 95' ' ' SER . 31.3 Cg_exo -63.3 -22.37 72.1 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.091 2.527 . . . . 10.0 111.827 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -67.95 -26.75 66.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.267 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -106.57 -40.0 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.881 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.606 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 74.1 m -128.82 136.16 28.72 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.539 0.209 . . . . 10.0 110.941 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.43 155.38 62.7 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.709 2.273 . . . . 10.0 111.812 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.19 133.32 41.43 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.107 2.538 . . . . 10.0 112.591 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.57 104.45 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.856 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 33.4 tp -131.19 124.21 20.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.221 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.8 Cg_exo -61.55 138.08 73.39 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.812 2.341 . . . . 10.0 111.923 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.11 -38.74 87.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.003 0.43 . . . . 10.0 111.309 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 29' ' ' VAL . 8.8 m -65.25 -18.23 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.241 0.543 . . . . 10.0 111.049 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.544 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 92.7 mmm -113.81 44.34 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.699 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 70.1 tttt -120.29 -51.26 0.04 OUTLIER Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.631 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.699 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 71.6 Cg_endo -75.42 55.26 4.11 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.223 1.949 . . . . 10.0 112.48 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.544 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.0 mt-30 -127.25 148.78 50.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.244 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -74.77 160.11 31.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 17.8 m -90.31 136.49 33.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.478 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.98 -135.05 2.34 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.187 -0.53 . . . . 10.0 113.262 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.62 -53.08 4.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.861 0.363 . . . . 10.0 111.376 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.884 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 23.7 m -70.64 159.81 33.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.398 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.42 127.12 30.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.989 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 t30 71.95 17.79 5.15 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.806 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.801 ' HG3' ' HB2' ' B' ' 111' ' ' SER . 0.5 OUTLIER -76.41 120.12 21.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -100.32 124.28 45.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.072 0.463 . . . . 10.0 111.258 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.59 97.1 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.47 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -60.86 128.29 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.303 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.974 179.88 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.234 0.244 0 CA-C-O 120.902 0.382 . . . . 10.0 110.828 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.797 ' HB3' ' HG2' ' C' ' 41' ' ' GLU . 5.3 ttpp -105.29 107.57 18.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.742 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 43.7 mt -91.33 113.64 25.96 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 5.5 mt -102.89 122.91 55.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.601 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.0 p -94.38 167.66 11.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -9.37 29.18 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.099 0.407 . . . . 10.0 112.099 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -86.61 -4.83 59.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.134 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.99 17.57 69.55 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.253 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.45 126.17 39.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 33.3 mt-10 -94.95 134.31 37.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.717 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 99.2 m-85 -123.4 104.89 9.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.77 0.319 . . . . 10.0 111.106 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.627 HD11 ' HD3' ' C' ' 2' ' ' LYS . 24.4 mm -88.69 115.75 29.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.403 -0.591 . . . . 10.0 109.403 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 41.8 t -105.86 127.78 60.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.622 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.419 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 77.9 tttt -54.99 129.4 37.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.29 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.476 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 32.4 ttt-85 -57.45 -30.86 65.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 10.0 112.038 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.16 -43.15 73.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.052 0.453 . . . . 10.0 110.644 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -81.33 -41.74 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.614 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 18' ' ' ALA . . . . . 0.476 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -56.26 -33.78 65.79 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.733 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 50.9 mt -59.35 -44.93 92.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.85 0.357 . . . . 10.0 110.379 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.571 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.2 m -65.25 -46.42 80.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.417 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -37.43 86.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.924 0.392 . . . . 10.0 110.524 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.47 -17.77 74.82 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 116.064 -0.516 . . . . 10.0 112.09 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -80.65 -25.93 37.99 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 41.3 mt -79.41 154.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.413 -0.812 . . . . 10.0 108.931 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -71.8 87.64 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.006 0.432 . . . . 10.0 111.319 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.49 179.69 5.45 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.316 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.29 36.02 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.986 0.422 . . . . 10.0 111.48 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 9.9 tp -66.98 -31.71 72.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.326 0.584 . . . . 10.0 109.845 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 9.72 24.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.348 -0.842 . . . . 10.0 110.589 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.61 -64.47 3.69 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.877 -0.602 . . . . 10.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.61 177.11 7.22 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.694 2.262 . . . . 10.0 111.477 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.19 -77.6 0.27 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.969 -0.634 . . . . 10.0 112.215 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -117.21 116.88 28.14 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 10.0 110.521 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -95.3 89.87 5.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.82 164.43 26.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.198 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.8 -26.52 58.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.023 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -59.11 -52.76 64.34 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.463 ' O ' HG22 ' C' ' 42' ' ' VAL . 4.7 mp0 -72.63 -20.28 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.319 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 7.1 m -71.76 -29.6 64.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 10.0 110.69 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -93.03 -33.46 14.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.732 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.797 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 30.8 mt-10 -135.5 98.81 4.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.04 0.447 . . . . 10.0 110.301 179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.463 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.1 t -90.38 132.4 35.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.314 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -106.44 115.15 29.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.478 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.514 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.2 m-85 -104.1 112.88 26.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.511 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -102.86 148.19 25.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.15 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 70.13 14.59 7.69 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.687 0.617 . . . . 10.0 110.725 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.514 HD12 ' HB3' ' C' ' 44' ' ' PHE . 69.5 mt -125.19 108.27 27.41 Favored Pre-proline 0 N--CA 1.455 -0.203 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.38 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 32.0 Cg_exo -61.24 150.75 83.19 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.122 2.548 . . . . 10.0 112.384 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.2 p -61.46 -39.81 92.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 50' ' ' HIS . . . . . 0.413 ' CE1' ' HG3' ' B' ' 103' ' ' MET . 59.6 m80 -52.86 -56.52 15.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 10.0 112.66 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.478 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.4 m -65.2 -35.9 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.929 -0.308 . . . . 10.0 111.255 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -66.0 -35.21 79.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -61.19 -43.32 99.07 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.37 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -65.92 -35.85 81.77 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.218 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -64.12 -46.51 93.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.539 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.8 -42.52 99.11 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.624 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.53 -37.8 83.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.664 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.8 t80 -63.73 -44.03 94.76 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.995 -0.372 . . . . 10.0 109.995 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.6 m-85 -62.9 -44.21 96.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.087 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 58.6 m -57.83 -45.02 86.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.321 0.581 . . . . 10.0 109.783 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -65.56 -44.84 85.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.072 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -60.49 -40.64 92.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.296 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.571 HG22 ' HB ' ' C' ' 20' ' ' THR . 38.2 t -58.0 -48.48 84.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.458 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -74.01 -39.01 63.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.242 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.488 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 63.0 t80 -58.01 -45.57 86.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.416 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.41 23.95 2.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.131 0.491 . . . . 10.0 110.667 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -128.86 -62.41 1.01 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.57 -25.52 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.488 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.4 m -83.61 34.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.275 0.472 . . . . 10.0 112.275 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -6.5 59.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.567 0.698 . . . . 10.0 109.658 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -65.87 -26.48 67.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.738 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.632 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 23.0 pt -102.77 164.72 15.02 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.639 . . . . 10.0 109.437 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 74.0 Cg_endo -74.8 -170.85 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.458 2.105 . . . . 10.0 112.717 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -72.09 165.88 23.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.655 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -48.66 128.15 13.77 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 123.463 0.477 . . . . 10.0 111.011 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -50.14 121.89 8.34 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 123.104 2.536 . . . . 10.0 112.586 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.656 HG22 ' HA ' ' A' ' 16' ' ' LEU . 19.7 pt -79.04 52.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.669 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.518 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -99.34 -56.47 0.16 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.182 -0.463 . . . . 10.0 112.214 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.518 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 57.6 Cg_endo -70.21 117.4 5.09 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.616 1.544 . . . . 10.0 111.022 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 5.6 pt-20 -73.67 -2.61 23.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 39.7 mm -81.62 72.73 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.594 0.711 . . . . 10.0 110.604 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -137.89 -38.23 0.58 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.218 -0.901 . . . . 10.0 109.424 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.404 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.0 tp -67.97 -24.73 65.19 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.945 -0.761 . . . . 10.0 108.945 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.507 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 23.8 mp0 -62.98 -31.76 72.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.699 178.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.663 ' HB3' HD21 ' A' ' 8' ' ' LEU . 54.6 mt -77.66 -32.4 53.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.649 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -22.09 63.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.386 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.1 ttp -66.6 -19.71 65.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.332 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.68 -34.28 77.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.986 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.39 -56.97 0.5 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.959 0.787 . . . . 10.0 112.54 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -82.49 41.31 0.7 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.144 0.497 . . . . 10.0 110.592 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.241 0.647 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.641 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 112.475 -0.25 . . . . 10.0 112.475 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -68.97 -65.22 0.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.12 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.649 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.2 tp -61.31 -30.96 70.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.022 -178.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.641 HE21 ' N ' ' A' ' 6' ' ' GLY . 3.2 tt0 -54.73 -29.7 54.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.944 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -105.09 -37.32 6.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.587 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.596 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 80.6 mt -64.06 -44.6 91.96 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.12 -30.32 66.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 10.0 111.298 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.8 tp -66.27 -35.69 81.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.163 0.506 . . . . 10.0 110.254 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.28 -2.43 52.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.002 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -100.99 -23.2 14.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.546 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 12.3 tp -169.46 109.77 0.44 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.099 -0.5 . . . . 10.0 111.075 179.2 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.8 mt -82.92 83.69 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.566 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 21.5 tttt -92.35 111.37 50.15 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.394 -179.381 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -91.97 38.82 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.12 2.547 . . . . 10.0 112.554 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 45.5 mttm -93.48 166.13 12.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.772 0.32 . . . . 10.0 110.844 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -82.93 156.54 23.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -106.67 143.7 17.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.287 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.021 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -157.31 140.77 11.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.835 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.537 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 27.7 Cg_exo -36.08 131.52 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.802 3.001 . . . . 10.0 113.052 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.642 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.7 Cg_endo -57.18 144.05 91.56 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.432 2.755 . . . . 10.0 113.25 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mt -75.41 122.02 86.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.896 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.81 -23.28 75.89 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 123.037 2.492 . . . . 10.0 112.897 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -31.18 72.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.151 0.5 . . . . 10.0 110.47 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.484 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 m -128.46 -139.33 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.227 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.484 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 1.1 ptp180 -149.89 60.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.329 0.585 . . . . 10.0 110.352 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.4 tttm -154.64 150.55 27.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.894 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -72.98 152.65 41.27 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.837 0.351 . . . . 10.0 111.453 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.68 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.9 m -90.32 168.37 11.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.837 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 33' ' ' THR . 11.0 tt0 -114.49 107.75 15.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.782 0.325 . . . . 10.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.021 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.6 t70 -157.94 -82.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.337 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 178.6 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 O-C-N 123.482 0.489 . . . . 10.0 110.614 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.294 -0.86 . . . . 10.0 110.689 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.3 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.935 0.398 . . . . 10.0 110.512 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -77.7 135.55 38.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.406 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 94.4 t -120.67 118.84 57.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.991 0.424 . . . . 10.0 110.563 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.613 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 59.2 m-85 -106.19 112.01 24.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.057 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -127.37 158.8 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.82 0.343 . . . . 10.0 111.179 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.579 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.9 mtm -127.0 107.28 9.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.636 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.445 ' HB ' ' HB ' ' B' ' 14' ' ' ILE . 48.6 mm -78.43 106.33 8.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -101.75 101.52 12.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.259 0.552 . . . . 10.0 112.487 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.742 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.6 ttp85 -91.72 72.56 5.81 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.377 -1.342 . . . . 10.0 107.377 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.658 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.7 t-160 67.6 -80.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.075 -177.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 58.1 mttt -116.02 -5.46 11.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.97 0.414 . . . . 10.0 111.132 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.742 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 3.0 m -96.58 94.6 7.44 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 2.9 m -95.86 112.31 24.07 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.939 0.4 . . . . 10.0 110.851 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.8 mt -106.37 116.8 50.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.988 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -77.15 116.83 18.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.72 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -112.1 112.29 23.8 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.335 0.588 . . . . 10.0 111.854 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.895 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.3 t70 -100.76 103.48 14.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.432 -1.321 . . . . 10.0 107.432 178.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.13 -164.39 1.28 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.314 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -125.4 153.55 43.24 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.23 -27.35 61.95 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.169 0.433 . . . . 10.0 112.169 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -8.6 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 16.4 m -84.4 147.61 27.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.622 0.249 . . . . 10.0 110.704 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 8.2 p -92.42 163.47 13.84 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.313 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 83.5 t -64.0 -36.71 77.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.591 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.17 -32.51 71.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' B' ' 29' ' ' ARG . 39.1 mt-10 -67.3 -31.59 71.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.066 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.494 HD11 HD21 ' B' ' 57' ' ' LEU . 85.1 mt -62.26 -42.38 99.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.705 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 94.9 mttt -62.95 -37.35 86.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.061 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' B' ' 26' ' ' GLU . 81.6 mtp180 -61.84 -43.22 99.29 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.968 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.09 -48.93 81.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.093 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.6 t -61.14 -36.45 72.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.758 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.494 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.1 tt0 -60.66 -35.02 75.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.148 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.72 -18.52 72.81 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.574 -0.822 . . . . 10.0 112.276 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.3 mt -92.21 -53.46 8.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.749 0.309 . . . . 10.0 111.226 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.4 mt -84.08 -13.28 53.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 mttt 63.01 32.58 15.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.675 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -121.0 138.83 28.3 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.24 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.5 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 77.3 Cg_exo -50.33 135.08 39.07 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.314 2.676 . . . . 10.0 112.895 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.705 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 7.1 Cg_exo -74.02 -16.1 23.04 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.037 2.491 . . . . 10.0 112.521 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.78 -35.99 79.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.027 -0.533 . . . . 10.0 112.028 -178.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -101.49 16.99 23.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -92.29 124.42 36.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.1 mmt-85 -112.24 114.05 26.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.438 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -98.21 113.35 25.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.333 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' TYR . . . . . 0.464 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 94.2 m-85 -112.21 122.59 48.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.696 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.555 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 30.5 tttm -124.99 130.29 52.06 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.17 35.83 18.31 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.472 0.482 . . . . 10.0 110.488 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 68.94 12.43 8.62 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.212 -0.904 . . . . 10.0 112.908 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -129.12 157.29 42.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.884 0.373 . . . . 10.0 111.496 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.35 143.35 33.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.405 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 46' ' ' LYS . 93.6 mt -93.05 156.68 16.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.243 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.434 ' OD2' ' HG3' ' B' ' 55' ' ' LYS . 15.2 t0 -92.98 119.88 32.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.788 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -57.57 -31.89 66.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.056 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.01 -3.74 90.64 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.611 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.434 ' HG3' ' OD2' ' B' ' 52' ' ' ASP . 41.3 mttp -101.1 153.72 19.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.47 . . . . 10.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.8 p -88.4 167.97 13.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.197 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.494 HD21 HD11 ' B' ' 27' ' ' LEU . 67.8 mt -60.49 -42.83 97.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 10.0 110.74 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.44 -41.52 98.62 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.622 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.24 -29.29 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.312 . . . . 10.0 111.686 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.7 m -79.85 -5.73 56.03 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.93 10.03 41.11 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.584 -0.817 . . . . 10.0 113.312 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 52.7 m-85 -79.96 67.39 5.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.179 0.514 . . . . 10.0 110.828 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.51 155.16 23.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.053 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -26.32 63.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.0 0.428 . . . . 10.0 111.728 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.11 -26.51 64.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.399 . . . . 10.0 110.917 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.69 -51.91 4.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.616 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.613 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -89.45 95.86 10.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.502 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -109.8 156.14 40.33 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.084 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.26 -14.36 37.55 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.306 2.004 . . . . 10.0 110.407 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.44 -7.4 21.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.995 -1.002 . . . . 10.0 109.956 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.5 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.87 88.61 1.69 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.363 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.579 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 9.0 Cg_exo -74.25 147.74 37.91 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.732 2.288 . . . . 10.0 111.58 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.86 110.27 10.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.999 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.59 119.37 14.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.715 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.407 ' HB ' HD13 ' B' ' 7' ' ' ILE . 41.4 t -115.7 134.83 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.72 126.61 7.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.479 -0.867 . . . . 10.0 112.169 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.444 ' HB2' HG23 ' B' ' 7' ' ' ILE . 23.6 tp -111.12 105.6 14.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.908 0.385 . . . . 10.0 111.049 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.64 124.72 50.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.651 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -95.77 119.0 33.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.797 0.332 . . . . 10.0 110.116 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 18.9 ttp180 -79.66 78.8 6.2 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.923 -0.581 . . . . 10.0 111.099 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -98.52 129.65 45.09 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.692 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -68.18 150.08 48.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.988 -0.551 . . . . 10.0 109.768 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 70.11 7.62 6.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.561 0.538 . . . . 10.0 110.832 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 86' ' ' GLU . 7.0 m -123.12 132.89 54.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.141 -179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -100.46 -4.26 29.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.43 . . . . 10.0 111.011 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.489 ' H ' HG22 ' B' ' 84' ' ' THR . 37.4 tt0 -62.05 -24.63 67.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.686 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.98 74.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.871 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.65 -14.38 60.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.807 0.336 . . . . 10.0 111.666 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 51.2 m -84.18 -28.31 27.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.134 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.658 HG12 ' HB2' ' B' ' 10' ' ' HIS . 22.6 mt -94.51 -25.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.531 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.464 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 43.2 tt0 -69.41 112.63 12.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.67 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' B' ' 95' ' ' SER . 14.4 Cg_exo -72.0 -10.95 26.84 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.262 2.642 . . . . 10.0 111.416 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -74.85 -33.17 62.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.243 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -102.51 -40.17 6.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.549 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.603 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 6.8 m -119.43 142.63 32.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.535 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 96' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.38 152.97 80.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.765 2.31 . . . . 10.0 111.99 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.43 126.35 22.18 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.084 2.522 . . . . 10.0 112.193 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -66.14 112.71 4.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.787 -0.642 . . . . 10.0 111.77 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 32.2 tp -139.34 120.57 9.77 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.498 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.84 128.59 31.08 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.069 2.513 . . . . 10.0 112.076 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -59.62 -31.78 69.81 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.949 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.455 ' HB ' HG12 ' A' ' 29' ' ' VAL . 19.3 m -71.03 -17.55 20.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.19 0.519 . . . . 10.0 111.338 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.418 ' HG2' HG23 ' B' ' 102' ' ' VAL . 81.0 mmm -122.56 58.29 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.664 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 23.4 ttpt -135.02 -54.48 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.492 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -75.55 60.36 5.81 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.612 2.208 . . . . 10.0 112.218 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -123.44 -156.68 0.72 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.157 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.579 ' HB2' HE22 ' B' ' 118' ' ' GLN . 16.4 t0 -113.15 172.53 6.89 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.923 -0.311 . . . . 10.0 110.443 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 15.9 m -99.97 136.28 40.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.058 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.34 -144.99 9.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.563 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -35.95 11.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.925 0.393 . . . . 10.0 110.655 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.597 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 49.9 m -80.59 158.37 25.75 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.382 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 112' ' ' ALA . . . . . 0.409 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.65 123.71 20.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.908 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 73.17 5.6 5.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.761 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.597 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 45.6 tt0 -71.6 131.5 43.3 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 179.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -110.36 138.93 46.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.077 0.465 . . . . 10.0 111.529 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -108.88 111.21 22.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.807 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.575 ' H ' HD11 ' C' ' 81' ' ' ILE . 2.6 t -81.17 123.94 38.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.754 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.579 HE22 ' HB2' ' B' ' 107' ' ' ASP . 24.0 mp0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.176 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.147 0.498 . . . . 10.0 110.798 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.938 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 75.6 tttt -108.88 122.83 48.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.91 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.496 HD22 ' HE2' ' C' ' 44' ' ' PHE . 25.1 mt -101.32 120.46 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.534 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.693 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.6 mt -105.65 115.81 48.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -87.13 173.69 9.09 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.919 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.9 m -68.17 -21.19 64.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.244 0.545 . . . . 10.0 110.704 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.81 -8.4 56.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.685 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.41 12.09 73.71 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.573 -0.822 . . . . 10.0 111.461 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 9' ' ' HIS . . . . . 0.404 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -81.04 134.46 35.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.938 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 6.7 mt-10 -103.56 106.93 17.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.265 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -98.31 109.99 22.65 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.714 0.292 . . . . 10.0 111.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.593 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 14.6 mm -94.38 112.81 27.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.39 133.74 42.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.718 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.895 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.6 tttt -59.3 128.64 38.12 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -53.88 -35.19 61.3 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.239 0.337 . . . . 10.0 111.674 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -56.74 -40.28 75.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.145 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -86.32 -33.33 20.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.066 0.46 . . . . 10.0 110.084 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.86 -40.04 93.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.344 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.34 -47.18 86.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.309 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.442 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.0 OUTLIER -65.32 -40.06 93.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.691 179.495 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -65.29 -36.72 84.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.167 0.508 . . . . 10.0 109.824 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.27 -6.58 86.46 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.268 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -79.12 -27.33 42.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -83.38 143.32 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -66.49 95.42 0.32 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.471 . . . . 10.0 111.317 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -98.85 -171.3 2.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.144 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.525 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.8 mmm -79.59 31.81 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.847 0.356 . . . . 10.0 111.952 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 16.3 tp -66.17 -39.23 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.316 0.579 . . . . 10.0 110.016 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.51 7.04 24.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.593 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.95 -64.72 3.71 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.655 -0.702 . . . . 10.0 112.583 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.99 173.4 8.39 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.473 2.116 . . . . 10.0 111.666 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.96 -63.64 5.14 Favored Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.968 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -140.04 125.02 18.5 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.892 0.377 . . . . 10.0 110.134 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -88.25 110.16 20.51 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.287 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.5 152.82 28.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.218 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 36' ' ' GLU . . . . . 0.515 ' H ' ' HG3' ' C' ' 36' ' ' GLU . 1.5 mt-10 -62.33 -33.93 75.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.231 0.539 . . . . 10.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.58 -35.78 78.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.34 -0.846 . . . . 10.0 109.545 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.4 ' O ' HG22 ' C' ' 42' ' ' VAL . 41.7 tp10 -77.36 -22.84 51.12 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.452 -0.795 . . . . 10.0 110.023 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -73.86 -34.31 64.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.19 0.519 . . . . 10.0 109.739 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -70.73 -47.26 60.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.756 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.693 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.5 mt-10 -133.0 97.22 3.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.743 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.4 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.5 t -83.11 125.77 40.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.07 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -94.14 111.34 23.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.935 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.496 ' HE2' HD22 ' C' ' 3' ' ' LEU . 64.7 m-85 -102.08 110.7 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.399 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -101.06 144.9 29.42 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.799 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 69.71 22.7 6.02 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.86 0.725 . . . . 10.0 110.491 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 76.6 mt -131.51 107.21 14.43 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.335 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -64.72 156.64 60.38 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 123.069 2.513 . . . . 10.0 112.249 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.6 p -69.12 -34.89 75.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.577 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -35.77 76.47 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.688 0.625 . . . . 10.0 112.688 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.436 ' O ' HG23 ' C' ' 55' ' ' VAL . 32.9 m -87.37 -31.37 5.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.401 -0.52 . . . . 10.0 111.209 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.68 -33.89 75.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.277 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -40.59 98.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.823 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 54' ' ' LYS . . . . . 0.491 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 60.0 tttp -64.49 -37.97 89.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.436 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.0 t -63.83 -46.25 94.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.83 -43.19 98.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.852 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.16 -38.78 91.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.874 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.596 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 83.5 t80 -64.6 -42.88 95.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.525 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.476 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.5 m-85 -62.37 -44.86 95.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.541 . . . . 10.0 109.912 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 29.1 m -60.0 -43.3 95.28 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.992 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -63.65 -42.17 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.173 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 12.6 tptt -64.3 -37.27 86.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.131 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.476 HG23 ' O ' ' C' ' 59' ' ' PHE . 55.6 t -60.28 -50.31 80.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.8 mmt180 -70.78 -31.27 67.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.442 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -62.52 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.091 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -75.7 -15.94 60.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.966 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.04 -55.77 4.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.945 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.5 p -145.95 -34.31 0.31 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.693 0.627 . . . . 10.0 112.693 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.469 ' O ' HG12 ' C' ' 72' ' ' ILE . 9.8 m -78.4 44.4 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.106 0.479 . . . . 10.0 112.216 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -18.35 26.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.552 0.691 . . . . 10.0 109.796 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 71' ' ' GLU . . . . . 0.466 ' HG2' ' H ' ' C' ' 71' ' ' GLU . 1.6 pt-20 -89.1 8.46 29.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.513 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.469 HG12 ' O ' ' C' ' 69' ' ' SER . 18.0 pt -111.21 163.92 16.2 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.14 149.9 82.34 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.466 2.111 . . . . 10.0 112.676 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -70.66 165.45 22.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.32 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -45.31 128.66 5.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.285 0.365 . . . . 10.0 111.151 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.76 5.4 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.077 2.518 . . . . 10.0 112.482 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 16' ' ' LEU . 7.2 pt -79.54 57.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.5 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -118.8 -55.22 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.483 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 39.6 Cg_exo -58.47 107.59 0.34 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.987 1.791 . . . . 10.0 112.187 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -72.61 57.02 0.4 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.761 -0.654 . . . . 10.0 112.6 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 81' ' ' ILE . . . . . 0.575 HD11 ' H ' ' B' ' 117' ' ' VAL . 8.1 mm -125.24 -4.35 5.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.348 0.594 . . . . 10.0 109.919 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.68 -43.7 68.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.566 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 29.8 tp -67.1 -29.9 69.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.379 0.609 . . . . 10.0 109.425 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.481 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 12.3 mp0 -64.23 -34.74 78.8 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.459 178.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.649 ' HB3' HD21 ' A' ' 8' ' ' LEU . 89.4 mt -76.47 -27.82 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.265 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.459 HD12 HD12 ' C' ' 83' ' ' LEU . 94.6 mt -73.06 -15.69 61.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.776 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 87' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 51.9 ttp -61.91 -26.12 67.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.695 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.69 83.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.76 -58.21 0.44 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.902 0.751 . . . . 10.0 112.59 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -82.65 50.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.516 0.674 . . . . 10.0 110.337 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.519 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.87 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.652 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.76 -0.136 . . . . 10.0 112.76 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -68.63 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.69 0.626 . . . . 10.0 112.69 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.517 HD22 ' HD2' ' C' ' 91' ' ' PHE . 4.3 mp -66.3 -21.67 66.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.652 HE21 ' N ' ' A' ' 6' ' ' GLY . 8.3 tt0 -51.73 -31.96 28.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.335 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -115.49 -35.0 4.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.007 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.506 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.1 mt -63.0 -36.07 82.34 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.546 0.573 . . . . 10.0 112.546 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.54 72.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.682 0.277 . . . . 10.0 111.257 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.1 tp -68.31 -32.04 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.162 0.506 . . . . 10.0 110.667 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.07 -18.1 50.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.741 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 -11.68 29.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.055 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.558 ' HA ' HG22 ' C' ' 77' ' ' ILE . 12.7 tp -165.21 113.56 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.221 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.8 mt -90.14 78.72 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 71.0 tttt -107.37 102.55 44.58 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.643 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -91.99 53.1 0.69 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.946 2.431 . . . . 10.0 111.697 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -100.63 -177.15 3.4 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.918 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -86.77 152.7 22.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.767 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.444 HG23 HD22 ' A' ' 32' ' ' LEU . 29.8 mm -120.49 105.92 17.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.679 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.002 ' HG2' ' HD2' ' A' ' 24' ' ' PRO . 4.4 tttp -120.2 146.23 42.03 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 1.002 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 33.1 Cg_exo -32.87 133.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 124.227 3.285 . . . . 10.0 113.5 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.792 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 31.0 Cg_endo -62.24 155.27 57.73 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 123.216 2.611 . . . . 10.0 113.401 -178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 122.96 63.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.477 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.78 -16.11 51.27 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.457 2.771 . . . . 10.0 112.893 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -42.26 98.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 10.0 110.121 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.4 t -120.99 -113.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.709 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.7 ptp180 -171.9 57.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.062 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.46 ' HG3' ' HG2' ' C' ' 84' ' ' GLU . 20.3 tttm -152.8 151.92 31.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.134 -179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.792 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.8 pp -72.0 156.28 39.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.683 0.277 . . . . 10.0 110.977 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -96.43 161.82 13.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.475 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -101.69 124.95 48.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.657 -0.498 . . . . 10.0 109.657 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.654 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 9.5 t70 -174.91 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.109 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.7 -64.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.516 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.0 m0 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.141 -0.933 . . . . 10.0 109.281 179.796 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmm . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 120.831 0.348 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -177.93 104.1 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.657 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.508 HG11 HD13 ' B' ' 57' ' ' LEU . 55.5 t -119.56 123.66 71.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.282 0.563 . . . . 10.0 111.78 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.01 116.67 31.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.237 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.656 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -126.65 151.33 48.2 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.182 0.515 . . . . 10.0 112.326 -179.061 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 41.7 mtm -122.3 104.58 9.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.137 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.48 HD11 HD12 ' B' ' 5' ' ' LEU . 44.7 mm -81.75 104.24 10.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.58 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.4 ttt180 -101.54 104.31 15.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.0 ttp85 -91.93 69.79 5.48 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.493 ' CE1' ' HE2' ' B' ' 11' ' ' LYS . 6.7 t-160 66.98 -79.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.343 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.493 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 71.1 mmtt -110.03 -11.29 14.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.643 0.259 . . . . 10.0 111.345 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 102.93 12.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.646 -0.252 . . . . 10.0 110.887 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 17.8 m -101.72 124.29 47.12 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.872 0.368 . . . . 10.0 110.914 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.452 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.1 mt -116.41 122.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.987 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -84.66 122.65 29.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.851 0.358 . . . . 10.0 110.144 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.656 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -117.96 130.17 56.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.491 . . . . 10.0 111.634 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -110.74 103.89 12.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.97 -168.65 2.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.453 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -129.49 161.22 30.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 3.8 mp0 -54.26 -28.13 39.56 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.5 m -68.08 -25.43 65.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.4 m -73.24 137.4 44.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.619 0.247 . . . . 10.0 110.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 73.6 p -87.98 167.28 13.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.875 0.369 . . . . 10.0 111.181 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.751 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 70.7 t -65.1 -35.53 75.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.102 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' PHE . . . . . 0.672 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 52.5 t80 -62.19 -34.96 77.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.172 0.51 . . . . 10.0 110.517 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.406 ' O ' HG13 ' B' ' 30' ' ' ILE . 34.1 mt-10 -66.38 -31.17 71.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.847 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.917 HD11 HD21 ' B' ' 57' ' ' LEU . 63.8 mt -66.32 -43.98 84.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 10.0 109.949 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.07 -34.66 75.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -67.96 -32.96 73.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.447 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.406 HG13 ' O ' ' B' ' 26' ' ' GLU . 82.7 mt -69.5 -46.69 75.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -63.48 -35.07 71.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.542 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.6 tm-20 -60.53 -38.03 83.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.291 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.15 1.05 71.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.729 -0.748 . . . . 10.0 112.946 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.56 -56.05 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.891 0.377 . . . . 10.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.75 -13.72 44.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.503 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 90.9 mttt 61.7 31.64 18.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.728 -0.669 . . . . 10.0 112.166 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -105.04 142.86 25.53 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.654 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.16 125.22 17.48 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.893 2.395 . . . . 10.0 112.496 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.542 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 30.5 Cg_endo -64.11 -21.36 67.91 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.953 2.435 . . . . 10.0 112.322 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.31 -29.75 70.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -96.11 -4.07 43.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.78 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.9 135.19 35.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.935 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.486 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 80.8 mmt-85 -127.14 110.21 12.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.81 111.66 23.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.904 0.383 . . . . 10.0 110.661 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -107.44 109.95 21.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.758 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.483 ' HB3' HD21 ' B' ' 51' ' ' LEU . 7.8 tttt -118.52 134.01 55.42 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 62.35 32.0 17.1 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.253 0.549 . . . . 10.0 109.715 -178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 67.93 10.54 7.87 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.021 -0.991 . . . . 10.0 112.066 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -124.59 151.37 44.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.017 0.437 . . . . 10.0 111.303 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.8 tp -74.83 126.44 30.95 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.185 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.549 ' HB3' HG21 ' B' ' 24' ' ' VAL . 89.4 mt -72.48 153.54 41.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.899 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -93.1 112.34 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.961 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.751 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.7 m-20 -60.31 -27.24 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.137 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.66 -12.79 83.25 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.942 -0.647 . . . . 10.0 112.714 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -102.27 161.49 13.66 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.876 0.369 . . . . 10.0 111.038 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.6 p -90.97 172.9 8.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.885 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.917 HD21 HD11 ' B' ' 27' ' ' LEU . 87.1 mt -62.39 -29.61 70.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.525 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.49 -43.96 98.63 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.131 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -75.08 -15.21 60.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.76 0.282 . . . . 10.0 111.76 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 53.5 m -95.84 15.35 20.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.825 0.345 . . . . 10.0 111.782 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.37 41.56 96.46 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.017 -0.611 . . . . 10.0 113.115 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.502 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 23.4 m-85 -101.97 48.62 0.87 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.002 0.43 . . . . 10.0 110.228 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.01 149.79 49.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.512 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -22.69 65.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.977 0.418 . . . . 10.0 111.717 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.2 mm-40 -72.81 -32.03 65.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.066 0.46 . . . . 10.0 110.418 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.81 -37.97 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.797 179.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.5 92.14 3.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.508 -0.769 . . . . 10.0 109.138 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' OE1' ' B' ' 70' ' ' GLN . 7.8 mtt180 -106.74 163.5 16.85 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.775 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 29.0 Cg_endo -65.23 -16.27 53.97 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.334 2.023 . . . . 10.0 111.2 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.412 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -107.34 1.28 23.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.613 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.515 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -161.8 82.84 1.79 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.577 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.534 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -74.88 143.43 29.48 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.923 2.416 . . . . 10.0 111.987 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.77 118.05 13.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.805 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.76 123.26 26.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.44 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.456 ' HB ' HD13 ' B' ' 7' ' ' ILE . 34.9 t -122.99 136.32 60.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.26 134.38 12.4 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.73 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.47 102.76 10.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.897 0.38 . . . . 10.0 111.838 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.486 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.43 130.74 38.02 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -111.59 116.48 30.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.629 0.252 . . . . 10.0 110.998 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -70.99 104.25 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.179 0.514 . . . . 10.0 111.005 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -122.01 126.97 49.72 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.804 -0.634 . . . . 10.0 109.367 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -66.29 133.27 50.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.953 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 76.26 -22.38 0.28 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.265 0.839 . . . . 10.0 113.265 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.4 m -85.25 106.39 16.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.994 0.426 . . . . 10.0 110.429 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -77.51 -4.36 45.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.163 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -60.07 -30.95 69.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.916 0.388 . . . . 10.0 110.897 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.54 -34.2 66.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.964 -0.562 . . . . 10.0 112.471 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.76 -30.04 69.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.4 m -79.6 -12.35 59.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.701 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 mt -100.29 -0.85 10.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 10.0 111.098 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 32.9 tt0 -97.81 110.89 57.36 Favored Pre-proline 0 C--N 1.323 -0.553 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -70.73 2.49 4.02 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.257 2.638 . . . . 10.0 112.383 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.553 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 19.0 t80 -94.1 -18.67 21.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.213 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.4 p -118.94 -42.11 2.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.165 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.3 m -106.52 153.33 40.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.991 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.04 159.09 23.91 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.382 2.055 . . . . 10.0 111.366 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.66 126.23 20.01 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.585 2.19 . . . . 10.0 111.591 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -70.99 103.81 2.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.505 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.6 tp -131.38 126.54 21.33 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.447 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.646 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 51.1 Cg_exo -54.67 134.07 60.4 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.819 2.346 . . . . 10.0 111.768 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.01 -37.64 88.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.272 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.6 m -73.51 -15.95 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.324 0.583 . . . . 10.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.646 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 89.7 mmm -112.78 39.14 2.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.508 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.63 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.2 ttpt -115.76 -53.74 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.169 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 9.9 Cg_exo -73.11 69.77 3.85 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 122.314 2.01 . . . . 10.0 111.553 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.2 mt-30 -137.1 170.68 15.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.608 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 4.7 t0 -85.63 175.54 8.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.785 0.326 . . . . 10.0 110.794 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.3 m -96.63 143.65 27.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.348 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' GLY . . . . . 0.5 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.18 -153.21 29.67 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.213 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -33.73 13.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.212 0.529 . . . . 10.0 110.877 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.515 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 50.8 m -89.09 163.41 15.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.879 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.61 132.13 45.72 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.041 -0.725 . . . . 10.0 109.041 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.85 -0.28 3.41 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.709 0.63 . . . . 10.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.5 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 35.7 tt0 -76.49 131.61 39.11 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -115.48 151.33 34.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.053 0.454 . . . . 10.0 111.365 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -118.21 106.02 12.38 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.046 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.623 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -69.52 127.86 32.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.809 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' B' ' 106' ' ' GLN . 11.6 mp0 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.412 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.134 0.492 . . . . 10.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.68 ' HE2' HG12 ' C' ' 4' ' ' ILE . 61.5 tttt -105.42 121.93 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.586 -0.734 . . . . 10.0 110.847 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.632 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.1 mt -95.7 115.06 26.88 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.724 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.9 mt -98.7 109.78 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.5 p -83.33 170.82 14.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.73 0.3 . . . . 10.0 110.975 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.1 m -67.84 -19.8 65.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.886 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -82.91 -4.87 58.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.079 0.466 . . . . 10.0 110.296 179.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.22 65.57 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.406 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.96 130.49 34.53 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -95.17 117.16 29.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.238 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.632 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 87.9 m-85 -108.25 106.47 16.65 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.686 0.279 . . . . 10.0 110.882 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.452 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.3 mm -94.34 116.54 35.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.63 136.17 43.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.591 0.234 . . . . 10.0 110.88 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -58.62 129.37 41.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 26.9 ttt180 -57.94 -25.53 61.04 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 112.683 0.623 . . . . 10.0 112.683 -178.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -55.17 -49.81 70.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.198 0.523 . . . . 10.0 110.149 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -77.95 -32.14 51.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.864 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 18' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -63.06 -37.22 86.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.342 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 64.8 mt -59.98 -52.4 65.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.978 0.418 . . . . 10.0 110.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.47 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.7 m -62.1 -44.21 97.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.6 m -62.1 -38.78 90.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.996 0.427 . . . . 10.0 110.848 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.29 -10.11 78.16 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.066 -0.588 . . . . 10.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 23.6 m -86.5 -25.17 25.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.249 0.547 . . . . 10.0 109.582 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 24' ' ' ILE . . . . . 0.556 HG22 ' H ' ' C' ' 25' ' ' LYS . 6.5 mt -75.1 170.61 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.883 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 25' ' ' LYS . . . . . 0.556 ' H ' HG22 ' C' ' 24' ' ' ILE . 31.8 tttp -73.29 78.33 1.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 10.0 110.681 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.14 9.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.796 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.644 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 87.3 mmm -80.31 45.18 0.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.712 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tt -70.24 -37.5 74.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.045 0.45 . . . . 10.0 110.233 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.73 12.91 13.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.841 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.3 -60.97 6.13 Favored Glycine 0 CA--C 1.523 0.537 0 CA-C-N 115.789 -0.641 . . . . 10.0 113.027 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -67.91 -178.31 1.61 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.621 2.214 . . . . 10.0 112.253 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.3 -49.08 68.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.891 -0.671 . . . . 10.0 112.158 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -149.69 133.38 16.81 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.23 100.8 12.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.032 0.444 . . . . 10.0 110.352 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.48 159.13 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.042 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.3 -28.59 63.19 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -61.83 -42.54 99.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.046 0.45 . . . . 10.0 110.083 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.492 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.2 tp10 -72.8 -20.29 61.18 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -79.78 -32.0 40.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.209 0.528 . . . . 10.0 109.621 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -75.04 -51.05 14.51 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.724 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.7 mt-10 -131.55 106.63 8.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.76 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.492 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -92.82 115.07 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.535 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -90.15 113.75 25.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.979 0.419 . . . . 10.0 111.176 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.56 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.4 m-85 -102.26 103.13 13.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -92.35 148.44 22.13 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 69.1 17.57 8.45 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.808 0.693 . . . . 10.0 110.716 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.436 HD12 ' HB3' ' C' ' 44' ' ' PHE . 77.8 mt -129.84 108.17 16.91 Favored Pre-proline 0 C--O 1.237 0.425 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.793 -179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.33 149.39 91.36 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.069 2.512 . . . . 10.0 112.504 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 6.4 p -62.77 -40.07 96.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.576 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.72 -53.15 58.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 10.0 112.257 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.2 m -68.21 -34.47 66.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.904 -0.319 . . . . 10.0 111.217 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.17 -30.8 71.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.946 0.403 . . . . 10.0 110.332 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -62.97 -40.57 98.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.499 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -68.1 -35.13 77.66 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.284 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 61.4 t -63.18 -46.32 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.619 179.004 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.31 -41.59 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.902 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 63.3 mtm -65.66 -40.76 92.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.914 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.506 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.6 t80 -64.28 -42.22 96.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.603 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.42 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.3 m-85 -62.94 -44.5 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.278 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 43.4 m -58.88 -43.09 90.86 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.488 0.661 . . . . 10.0 109.794 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.59 -43.43 84.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.117 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -61.42 -39.68 91.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.362 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.47 HG22 ' HB ' ' C' ' 20' ' ' THR . 46.4 t -60.43 -45.03 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.416 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -77.31 -38.83 49.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.72 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.587 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -55.21 -52.39 63.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.491 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.7 50.59 1.92 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.599 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -158.56 -54.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.438 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -139.77 -38.08 0.48 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.279 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.587 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -80.06 40.18 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.917 0.389 . . . . 10.0 111.769 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.7 -8.03 56.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.291 0.567 . . . . 10.0 110.244 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -79.72 -27.71 40.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.149 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.674 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 27.5 pt -92.22 165.3 20.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.842 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.674 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 70.4 Cg_endo -73.68 -178.33 3.68 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.329 2.019 . . . . 10.0 113.422 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -78.58 173.37 12.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.32 -0.854 . . . . 10.0 108.907 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.31 129.77 51.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 123.104 0.252 . . . . 10.0 110.445 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.3 123.02 10.35 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.121 2.548 . . . . 10.0 112.534 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.558 HG22 ' HA ' ' A' ' 16' ' ' LEU . 23.0 pt -82.09 38.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.494 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.468 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -92.57 -57.03 0.24 Allowed Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 10.0 112.081 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 37.8 Cg_endo -66.78 103.48 0.71 Allowed 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.119 1.879 . . . . 10.0 111.189 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.648 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 26.4 mt-10 -76.71 51.93 0.79 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.708 0.633 . . . . 10.0 112.708 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 27.8 mm -118.34 -9.18 11.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.479 0.657 . . . . 10.0 110.096 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.3 -29.31 66.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.255 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.483 HD22 ' HG2' ' A' ' 18' ' ' LYS . 11.6 tp -73.25 -26.14 60.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.181 0.515 . . . . 10.0 110.165 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.498 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 5.4 mp0 -63.7 -27.36 69.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.715 179.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 8' ' ' LEU . 43.1 mt -76.85 -23.87 52.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.897 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 53.1 tp -72.53 -12.63 61.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.516 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 48.3 ttp -62.53 -29.13 70.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.983 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.54 78.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.687 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.81 -51.36 0.68 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.934 0.716 . . . . 10.0 112.934 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -83.76 34.32 0.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.221 0.534 . . . . 10.0 110.773 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.517 ' HD2' HD22 ' A' ' 8' ' ' LEU . 4.1 t80 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.639 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 112.102 -0.399 . . . . 10.0 112.102 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.73 -61.37 2.23 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.52 0.563 . . . . 10.0 112.52 -179.063 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.549 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.5 tp -63.6 -30.65 71.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.348 -178.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.639 HE21 ' N ' ' A' ' 6' ' ' GLY . 3.6 tt0 -56.7 -26.29 56.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.926 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -106.79 -38.64 6.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.443 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.5 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 62.3 mt -59.6 -39.87 85.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.942 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.06 -38.44 72.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.328 . . . . 10.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.38 -34.25 76.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.102 0.477 . . . . 10.0 110.785 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.9 0.74 46.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.924 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.47 -48.06 3.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.162 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.768 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.1 OUTLIER -140.08 110.02 6.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.89 -179.697 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.8 mt -76.17 114.89 16.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.702 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.812 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 53.2 tttt -126.6 92.03 45.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.873 0.368 . . . . 10.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -83.26 48.52 2.71 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.952 2.434 . . . . 10.0 111.979 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 54.3 mttt -93.15 -170.03 2.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.03 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -96.55 168.4 10.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.02 0.438 . . . . 10.0 111.612 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.0 mm -111.97 151.04 14.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.173 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.932 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -175.28 138.88 0.58 Allowed Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 179.213 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.596 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 53.3 Cg_exo -40.4 137.74 1.46 Allowed 'Trans proline' 0 C--O 1.239 0.566 0 C-N-CA 123.354 2.702 . . . . 10.0 113.058 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.4 Cg_endo -60.57 136.0 64.4 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.044 2.496 . . . . 10.0 112.059 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 31' ' ' LYS . 0.3 OUTLIER -76.18 123.65 88.05 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.643 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.0 -7.65 20.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.001 2.467 . . . . 10.0 112.466 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -36.6 78.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 10.0 111.034 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.571 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.1 t -132.88 -113.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.724 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.571 ' HG2' HG12 ' A' ' 29' ' ' VAL . 3.8 ptp180 -162.16 56.14 0.24 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.211 0.529 . . . . 10.0 110.912 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 tttm -151.57 155.19 37.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.863 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 1.1 pp -84.55 151.69 24.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.705 -0.479 . . . . 10.0 109.705 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HD2' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -86.97 175.92 7.9 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.633 -0.258 . . . . 10.0 110.386 -179.592 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 0.8 OUTLIER -124.47 119.53 29.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.652 0.263 . . . . 10.0 110.845 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.932 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -165.93 -70.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.269 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 175.37 -56.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.454 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.414 ' SD ' ' HD2' ' B' ' 19' ' ' LYS . 9.0 tmm? . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.831 0.348 . . . . 10.0 110.708 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.25 141.91 30.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.826 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.549 ' CG2' ' HG3' ' B' ' 20' ' ' GLU . 76.4 t -128.8 126.78 65.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.128 0.489 . . . . 10.0 110.826 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.405 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 54.4 m-85 -116.39 118.04 31.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.888 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.862 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -131.37 160.75 34.14 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.692 0.282 . . . . 10.0 111.13 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.629 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 58.1 mtm -127.83 108.63 10.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.863 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.599 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.9 mm -82.26 102.71 8.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.5 ttt180 -100.51 105.18 16.6 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.534 0.568 . . . . 10.0 112.534 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.541 ' HB2' HD23 ' B' ' 77' ' ' LEU . 20.6 ttp85 -94.14 82.67 4.17 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.959 -1.497 . . . . 10.0 106.959 177.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.538 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.2 t-80 66.79 -86.15 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.204 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -119.65 6.88 11.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.151 0.5 . . . . 10.0 111.102 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -105.86 95.19 5.62 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 6.4 m -95.09 117.13 29.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.016 0.436 . . . . 10.0 110.943 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.548 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 52.8 mt -108.17 117.23 53.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.555 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -74.04 116.68 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.862 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -107.7 114.22 28.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.234 0.54 . . . . 10.0 111.511 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.901 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 1.4 t70 -103.49 110.6 22.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -141.14 -159.78 1.0 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.979 0.419 . . . . 10.0 111.937 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.414 ' HD2' ' SD ' ' B' ' 1' ' ' MET . 38.0 mmtm -129.86 161.27 31.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.344 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.549 ' HG3' ' CG2' ' B' ' 3' ' ' VAL . 14.1 mt-10 -61.56 -24.49 66.68 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.663 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -16.61 59.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.303 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' SER . . . . . 0.469 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 19.2 m -76.04 144.03 41.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.501 0.191 . . . . 10.0 111.015 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 37.9 p -90.15 168.17 12.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.829 0.347 . . . . 10.0 111.042 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.401 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 79.4 t -67.42 -35.59 73.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.852 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 69.2 t80 -63.57 -32.81 74.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.1 0.476 . . . . 10.0 110.515 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.71 -34.08 77.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.417 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.726 HD11 HD21 ' B' ' 57' ' ' LEU . 69.9 mt -63.38 -44.65 94.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -62.1 -35.06 77.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.529 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -66.76 -34.38 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.222 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 85.8 mt -71.18 -45.55 70.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.55 -36.26 72.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.085 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -59.89 -39.82 86.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.66 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.64 -10.17 84.77 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.67 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.5 mt -103.04 -51.75 8.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 111.755 0.28 . . . . 10.0 111.755 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 58.5 mt -89.15 -13.06 39.28 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 57.83 43.5 21.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.399 0.618 . . . . 10.0 112.021 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -127.22 140.68 38.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.259 -0.882 . . . . 10.0 110.033 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -48.99 119.98 4.97 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.403 2.735 . . . . 10.0 112.986 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.72 -16.87 42.43 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.113 2.542 . . . . 10.0 112.258 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.71 -32.78 74.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.567 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -100.74 11.29 39.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.823 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -90.58 126.99 36.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' B' ' 43' ' ' ARG . 37.4 mmt-85 -110.98 123.31 49.93 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.3 121.49 45.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.622 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -119.97 129.84 54.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.814 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.513 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.2 tttm -130.0 129.45 43.75 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 64.93 25.98 12.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.011 0.434 . . . . 10.0 110.287 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 71.98 19.06 4.8 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.27 -0.877 . . . . 10.0 111.235 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -125.94 152.96 44.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.281 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -78.1 137.35 38.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.378 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' B' ' 46' ' ' LYS . 92.8 mt -85.98 165.22 16.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.191 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -112.07 121.18 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.684 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.529 ' HB3' ' HB2' ' B' ' 25' ' ' PHE . 44.7 m-20 -61.83 -28.99 69.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.203 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.98 -5.17 86.39 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.552 -0.832 . . . . 10.0 113.431 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -104.66 157.51 17.13 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.112 0.456 . . . . 10.0 111.433 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.0 p -89.25 165.14 14.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.613 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.726 HD21 HD11 ' B' ' 27' ' ' LEU . 45.8 mt -59.04 -42.48 90.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.313 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.35 -31.62 66.6 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.046 -0.597 . . . . 10.0 112.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -79.73 -23.73 42.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.028 0.442 . . . . 10.0 110.914 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 52.0 m -86.66 0.8 53.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.6 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.77 8.88 57.92 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.977 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.514 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 59.6 m-85 -80.6 98.51 7.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.888 0.375 . . . . 10.0 110.125 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.89 164.41 23.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.7 m -67.86 -10.94 57.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 10.0 112.048 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -77.93 -37.58 47.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.126 0.489 . . . . 10.0 110.066 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -48.08 6.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.852 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -94.26 96.47 9.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.784 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 1.0 OUTLIER -107.34 161.14 24.02 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.547 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 30.1 Cg_endo -65.41 -15.86 51.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.478 2.119 . . . . 10.0 111.481 178.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.75 2.14 23.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.987 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.84 85.91 1.25 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.576 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.629 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.1 Cg_exo -73.29 147.6 42.27 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.739 2.293 . . . . 10.0 111.334 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.97 116.23 11.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.02 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.74 117.13 11.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.443 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.599 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.5 t -117.01 133.68 62.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.67 128.7 9.24 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.657 -0.782 . . . . 10.0 112.409 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 9' ' ' ARG . 23.7 tp -113.11 114.35 26.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 10.0 111.022 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.95 124.61 53.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.657 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -100.5 113.58 26.48 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -77.32 112.74 14.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.963 0.411 . . . . 10.0 111.54 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.54 147.83 52.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.524 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 83' ' ' ASP . 32.0 t70 -71.46 139.62 49.71 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.07 -0.344 . . . . 10.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' B' ' 82' ' ' ASP . 19.4 t70 77.92 -31.0 0.16 Allowed 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.603 0.564 . . . . 10.0 112.224 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.9 m -83.3 95.11 8.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 10.0 111.059 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -74.23 -4.01 33.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.202 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.475 ' O ' HG13 ' B' ' 90' ' ' ILE . 35.4 tt0 -56.26 -32.44 64.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.663 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.07 76.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.209 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.2 mt -72.68 -18.76 61.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.978 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.15 -11.46 38.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.405 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.538 HG12 ' HB2' ' B' ' 10' ' ' HIS . 53.4 mt -101.44 -31.59 3.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.431 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.61 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 39.2 tt0 -66.03 114.15 15.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.484 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.516 ' HA ' ' O ' ' B' ' 95' ' ' SER . 8.4 Cg_exo -74.0 -0.65 9.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.1 2.533 . . . . 10.0 111.354 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.61 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 12.7 t80 -86.66 -16.09 37.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.987 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.24 -42.88 2.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.859 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 10.5 m -113.23 150.49 43.1 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.83 154.95 66.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.593 2.195 . . . . 10.0 111.553 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.73 130.6 37.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.882 2.388 . . . . 10.0 112.496 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.97 102.22 1.95 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.909 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.7 tp -140.27 130.0 13.55 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.833 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.458 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 50.1 Cg_exo -56.41 131.77 47.75 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.992 2.461 . . . . 10.0 111.803 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 101' ' ' ASP . . . . . 0.983 ' HA ' ' HD3' ' B' ' 104' ' ' LYS . 27.6 t0 -65.6 -34.42 78.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.486 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -68.97 -20.36 24.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.286 0.565 . . . . 10.0 110.532 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.458 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 65.4 mmm -107.6 54.97 0.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.65 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.983 ' HD3' ' HA ' ' B' ' 101' ' ' ASP . 32.9 mtpt -133.62 -47.71 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.97 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.839 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 64.6 Cg_endo -72.95 45.23 0.88 Allowed 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.166 1.911 . . . . 10.0 113.493 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 8.6 mp0 -119.38 175.0 6.03 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.649 -0.501 . . . . 10.0 109.649 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -90.49 165.86 13.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.637 0.256 . . . . 10.0 110.379 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 50.7 m -89.99 143.85 26.42 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.211 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 109' ' ' GLY . . . . . 0.487 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -83.96 -150.75 11.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.259 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.26 -27.93 15.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.36 0.6 . . . . 10.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.924 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 0.7 OUTLIER -96.68 165.72 12.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.273 -0.876 . . . . 10.0 110.871 -179.347 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.79 138.18 46.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.612 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 68.52 4.79 4.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.823 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.487 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 34.9 tt0 -86.07 128.93 34.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -114.67 141.68 47.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.941 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.21 101.17 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.845 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 3.7 t -74.04 133.97 30.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.787 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.994 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.893 0.378 . . . . 10.0 110.923 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.435 ' HE2' HG12 ' C' ' 4' ' ' ILE . 44.9 tttt -108.84 113.8 27.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.961 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.531 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 26.2 mt -91.29 127.83 36.88 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.435 HG12 ' HE2' ' C' ' 2' ' ' LYS . 8.2 mt -113.14 120.61 63.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.489 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -94.31 166.52 12.04 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.126 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -1.24 11.83 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.198 0.444 . . . . 10.0 112.198 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -95.06 2.96 55.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.851 0.357 . . . . 10.0 110.216 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.06 33.54 57.0 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.78 -0.724 . . . . 10.0 111.433 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -108.65 128.4 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -97.02 121.67 39.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.896 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.531 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 81.7 m-85 -112.35 110.03 20.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.601 0.239 . . . . 10.0 110.585 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.548 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 21.6 mm -96.06 116.03 36.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.9 t -104.72 135.9 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.406 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.901 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 22.2 tttt -58.97 131.89 52.39 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 65.8 ttt180 -57.89 -34.86 70.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 10.0 112.013 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.436 ' HB2' ' HD3' ' C' ' 14' ' ' LYS . 31.3 mt-10 -56.78 -38.11 72.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.693 0.282 . . . . 10.0 111.411 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -82.96 -32.67 26.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.141 0.496 . . . . 10.0 110.083 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.82 -29.72 70.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.89 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.8 mt -59.29 -55.9 28.96 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.417 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.8 -40.1 96.32 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.283 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.0 m -62.2 -35.34 78.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.469 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.44 -18.18 79.95 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.092 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 14.0 m -79.76 -28.57 40.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.089 0.471 . . . . 10.0 109.765 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mt -74.53 149.76 7.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.158 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.61 113.47 6.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 10.0 110.414 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -134.06 177.57 7.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.871 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.517 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.4 mmm -78.87 38.06 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.894 0.378 . . . . 10.0 111.581 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.64 -37.73 85.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.23 0.538 . . . . 10.0 110.019 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.5 m -91.56 18.58 7.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.314 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.53 -60.55 5.74 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.671 -0.695 . . . . 10.0 112.834 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.84 172.02 7.71 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.356 2.038 . . . . 10.0 112.311 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.23 -55.18 27.74 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 115.885 -0.598 . . . . 10.0 113.167 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -149.67 110.48 4.3 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.505 -0.409 . . . . 10.0 111.11 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -77.27 90.6 3.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.087 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.4 171.83 14.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.137 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.07 -33.59 69.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.329 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -60.85 -44.13 97.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.156 0.503 . . . . 10.0 109.85 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.431 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.0 mp0 -72.6 -26.21 61.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.685 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 10.4 m -74.07 -35.41 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.248 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -76.48 -50.92 12.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.109 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.425 ' HB3' HD11 ' C' ' 4' ' ' ILE . 29.9 mt-10 -124.8 107.32 10.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.302 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.431 HG22 ' O ' ' C' ' 38' ' ' GLU . 3.4 t -92.89 103.66 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.972 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -90.14 119.48 30.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.977 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.609 ' HB3' HD12 ' C' ' 47' ' ' ILE . 87.1 m-85 -98.81 142.29 30.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.214 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -112.58 135.72 52.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.405 -0.362 . . . . 10.0 111.609 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 64.92 19.48 11.86 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.47 -0.786 . . . . 10.0 112.197 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.609 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.0 mt -114.74 107.46 50.57 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.396 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 45.2 Cg_exo -59.71 149.52 82.39 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 123.191 2.594 . . . . 10.0 112.377 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -65.01 -35.86 82.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.758 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -56.16 24.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.953 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.527 ' HB ' HD21 ' C' ' 85' ' ' LEU . 35.7 m -67.62 -33.3 61.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.354 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.63 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -59.66 -38.04 80.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -67.11 -32.6 73.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.355 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.84 -46.76 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -59.84 -41.45 91.39 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.702 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 59.7 mtm -68.51 -39.32 81.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.787 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.5 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.0 t80 -63.07 -44.84 94.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.718 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.27 -44.99 95.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.397 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 57.8 m -58.73 -41.98 87.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.865 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.43 -47.41 76.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.914 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -59.04 -40.93 86.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.866 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 42.2 t -57.96 -50.23 78.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.625 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.423 ' HD2' HH11 ' C' ' 64' ' ' ARG . 10.7 mmt85 -72.07 -38.82 69.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.949 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.451 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 79.2 t80 -58.03 -42.37 85.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.111 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.47 19.94 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.005 0.431 . . . . 10.0 111.513 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -128.4 -44.66 1.38 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.803 0.335 . . . . 10.0 111.543 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.98 -38.67 0.27 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.956 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.521 ' O ' HG12 ' C' ' 72' ' ' ILE . 0.7 OUTLIER -79.68 41.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.868 0.322 . . . . 10.0 111.868 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.66 -18.96 33.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.329 0.585 . . . . 10.0 110.247 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -73.0 -14.62 61.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.952 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.555 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 17.1 pt -101.03 160.45 26.64 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.555 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 65.1 Cg_endo -73.93 175.27 11.05 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.318 2.012 . . . . 10.0 113.015 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.41 172.52 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.485 -0.78 . . . . 10.0 109.508 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -49.66 126.36 17.82 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 122.457 0.303 . . . . 10.0 110.528 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.28 122.77 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.295 2.664 . . . . 10.0 113.029 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.768 HG22 ' HA ' ' A' ' 16' ' ' LEU . 5.7 pt -76.58 59.77 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.752 -0.658 . . . . 10.0 112.341 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.714 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -112.96 -59.12 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.714 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 12.0 Cg_exo -71.56 106.84 2.04 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.159 1.906 . . . . 10.0 111.682 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.812 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 2.3 pt-20 -73.46 50.69 0.32 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.049 -0.523 . . . . 10.0 112.372 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -110.17 19.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.71 0.767 . . . . 10.0 109.862 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.5 -42.43 18.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.062 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.35 -30.17 70.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.208 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 13.1 mp0 -59.7 -41.67 91.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.998 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.549 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.3 mt -78.77 -38.04 39.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.705 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 2.9 tt -61.44 -32.37 72.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.357 -0.838 . . . . 10.0 110.846 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 33.0 ttp -59.6 -19.85 51.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.989 -0.55 . . . . 10.0 112.083 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.46 -32.49 71.44 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.54 -58.89 0.42 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 124.021 0.826 . . . . 10.0 113.223 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -82.04 39.45 0.57 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.164 0.507 . . . . 10.0 111.025 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.678 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.492 -0.243 . . . . 10.0 112.492 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.564 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.69 -66.18 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 -179.082 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 14.2 tp -63.98 -27.26 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.499 -178.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -55.34 -29.7 58.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.601 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -102.25 -40.43 6.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.96 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.611 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.4 mt -57.66 -36.11 71.44 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.498 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.48 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.72 0.295 . . . . 10.0 110.586 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.48 -31.22 70.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.383 0.611 . . . . 10.0 110.127 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.46 -18.18 61.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.819 . . . . 10.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.57 -53.21 4.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.24 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.89 132.62 21.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 111.593 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.2 mt -88.97 114.46 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 69.5 tttt -116.38 100.47 53.48 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.401 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -89.41 32.9 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.121 2.548 . . . . 10.0 111.826 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -92.23 170.4 9.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.004 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -83.23 160.51 21.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.906 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.6 mm -108.98 153.78 10.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.441 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.032 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.6 OUTLIER -167.18 133.76 1.85 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.88 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 44.3 Cg_exo -39.21 127.64 1.44 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.612 2.874 . . . . 10.0 113.031 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.89 127.5 24.59 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 123.349 2.699 . . . . 10.0 112.297 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -68.14 132.12 91.94 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.519 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.94 -20.58 45.38 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 123.445 2.763 . . . . 10.0 113.745 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -34.13 77.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.782 0.325 . . . . 10.0 111.244 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.557 HG22 ' HG ' ' A' ' 26' ' ' LEU . 24.1 m -128.37 -160.8 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.696 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' C' ' 50' ' ' HIS . 3.8 ptp180 -129.99 51.52 2.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 10.0 110.815 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -149.7 148.0 28.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.602 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' C' ' 84' ' ' GLU . 4.4 pp -72.01 154.27 41.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.909 0.385 . . . . 10.0 111.148 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.0 OUTLIER -92.03 162.42 14.38 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.756 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.2 tt0 -112.02 115.45 28.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.254 -0.276 . . . . 10.0 110.254 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.032 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.9 t70 -156.87 -76.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.865 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.18 -59.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.3 m0 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.359 -0.829 . . . . 10.0 109.857 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmm . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.59 0.233 . . . . 10.0 111.506 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.63 142.14 28.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.568 HG11 HD13 ' B' ' 57' ' ' LEU . 95.6 t -127.8 125.66 65.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.775 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.75 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 55.5 m-85 -113.77 112.35 23.28 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.615 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.62 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.57 158.04 41.08 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.785 0.326 . . . . 10.0 111.06 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.449 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 31.7 mtm -126.24 112.81 16.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.734 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' B' ' 75' ' ' VAL . 46.1 mm -84.32 105.69 13.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -100.85 102.35 13.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 32.3 ttp85 -92.38 65.33 4.51 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.036 -1.468 . . . . 10.0 107.036 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 65.11 -86.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.022 -0.99 . . . . 10.0 111.479 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -95.24 -21.65 18.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.665 0.246 . . . . 10.0 111.665 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -99.58 105.18 17.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.665 0.269 . . . . 10.0 111.684 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 26.4 m -103.18 121.39 42.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.716 0.293 . . . . 10.0 110.236 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.67 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.3 mt -111.08 117.95 56.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.434 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -77.39 113.09 14.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.62 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -106.26 108.27 19.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.325 0.583 . . . . 10.0 111.928 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 1.053 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 2.6 t70 -95.46 106.45 18.52 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.684 -1.228 . . . . 10.0 107.684 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -129.28 -165.85 1.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.548 -0.296 . . . . 10.0 111.286 -178.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -125.32 160.65 28.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.28 -21.87 66.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.91 0.386 . . . . 10.0 111.953 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -16.98 57.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.389 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.6 m -72.99 147.0 45.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.887 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.9 p -96.79 166.13 11.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.922 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.58 -35.17 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.184 0.516 . . . . 10.0 109.705 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -60.58 -37.55 81.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.994 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -65.07 -34.63 78.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.958 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.682 HD11 HD21 ' B' ' 57' ' ' LEU . 89.1 mt -59.93 -45.37 92.83 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.806 -0.442 . . . . 10.0 109.806 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -64.28 -34.03 77.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.539 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -67.26 -33.29 75.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.148 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.407 HD12 ' HA ' ' B' ' 27' ' ' LEU . 64.8 mt -72.14 -46.29 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 88.0 t -64.2 -31.64 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.234 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.7 tt0 -56.36 -43.11 78.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.973 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.26 -19.71 79.45 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 10.0 112.515 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 75.2 mt -87.69 -59.75 2.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 111.845 0.313 . . . . 10.0 111.845 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.6 mt -80.83 -12.67 59.39 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.086 0.402 . . . . 10.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 84.9 mttt 60.17 36.35 21.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.155 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 37' ' ' ARG . 27.3 mtt180 -127.65 144.82 52.5 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.731 -179.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.52 127.68 16.49 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.699 2.933 . . . . 10.0 113.856 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.771 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 52.7 Cg_endo -71.39 -19.76 28.44 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.886 2.391 . . . . 10.0 111.81 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.66 -28.85 68.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.691 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -94.28 0.23 55.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.32 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -84.93 129.03 34.87 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.241 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.516 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.9 mmt-85 -116.7 107.11 14.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.189 -0.459 . . . . 10.0 109.862 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.4 mt -89.63 113.73 25.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.554 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' TYR . . . . . 0.404 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 54.9 m-85 -110.8 113.59 26.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.125 0.488 . . . . 10.0 111.813 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.485 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 37.6 tttm -119.01 128.91 54.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 62.93 37.78 11.71 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.488 0.493 . . . . 10.0 110.947 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 64.36 21.43 12.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.218 -0.901 . . . . 10.0 112.027 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -136.73 155.65 49.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.8 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.7 tp -78.13 141.13 38.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.466 -0.333 . . . . 10.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 mt -84.89 151.82 24.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.076 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.522 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 30.9 t0 -88.72 118.57 28.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.281 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.15 -26.99 68.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 10.0 112.267 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.37 2.69 81.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.074 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 51.1 mttp -109.81 154.97 22.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.231 0.539 . . . . 10.0 111.731 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 36.5 p -86.79 172.21 10.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.501 -0.772 . . . . 10.0 109.59 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.682 HD21 HD11 ' B' ' 27' ' ' LEU . 54.2 mt -63.71 -37.63 88.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.701 0.286 . . . . 10.0 110.399 179.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.83 -33.74 87.83 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.893 -0.67 . . . . 10.0 112.182 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.57 -25.82 45.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.697 0.284 . . . . 10.0 111.525 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.9 m -89.41 0.96 56.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.18 64.31 1.66 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.714 -0.755 . . . . 10.0 113.096 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.485 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 24.5 m-85 -124.7 47.37 2.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.857 0.36 . . . . 10.0 110.175 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 79.1 p -68.34 164.02 21.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -17.39 63.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.765 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.84 -30.17 50.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.09 0.471 . . . . 10.0 110.239 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.94 -36.27 12.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.075 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.75 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -108.45 100.22 9.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 109.875 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.41 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 0.3 OUTLIER -115.04 157.0 44.55 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.21 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.87 -14.79 46.26 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.372 2.048 . . . . 10.0 111.33 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.498 ' H ' ' HG3' ' B' ' 70' ' ' GLN . 0.0 OUTLIER -106.78 0.86 24.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.622 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.497 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -164.51 90.29 1.04 Allowed Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.126 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.449 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -76.76 138.07 18.55 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.956 2.437 . . . . 10.0 111.449 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.96 122.88 16.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.666 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.03 122.6 25.16 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.569 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.445 ' HB ' HD13 ' B' ' 7' ' ' ILE . 45.3 t -125.6 129.24 72.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.37 140.85 19.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.785 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -119.86 105.46 11.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.049 0.452 . . . . 10.0 111.885 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.516 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.8 127.96 44.88 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -104.04 117.73 34.98 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.954 -0.298 . . . . 10.0 111.187 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -71.98 97.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.684 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.67 126.53 47.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.188 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.26 134.47 57.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.876 -0.602 . . . . 10.0 112.084 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 67.8 7.58 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.432 -0.804 . . . . 10.0 112.542 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 4.2 m -105.56 98.71 8.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.165 0.507 . . . . 10.0 110.325 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -66.92 -14.23 62.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.098 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -57.12 -32.17 66.07 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.998 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.48 67.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.79 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.7 mt -83.12 -5.25 59.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.521 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 27.2 m -105.28 -14.84 15.22 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.3 mt -104.23 6.29 10.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.155 0.502 . . . . 10.0 111.164 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.404 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 45.5 tt0 -104.52 107.24 57.36 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.173 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.618 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.5 Cg_exo -65.58 -10.66 27.22 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.049 2.5 . . . . 10.0 111.955 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -76.81 -20.68 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.912 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -119.14 -48.42 2.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.954 -0.567 . . . . 10.0 111.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.618 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 20.0 m -115.13 141.47 27.07 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.965 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.44 153.74 75.8 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.526 2.151 . . . . 10.0 111.929 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.19 141.46 94.44 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.046 2.497 . . . . 10.0 112.633 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -72.71 117.61 14.63 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.187 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 31.6 tp -146.32 124.23 6.18 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.486 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.415 ' HG2' ' HE1' ' C' ' 50' ' ' HIS . 22.7 Cg_exo -66.64 136.27 41.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.751 2.301 . . . . 10.0 112.13 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -66.83 -30.91 71.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.397 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.7 m -70.91 -16.04 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.496 0.665 . . . . 10.0 110.243 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.723 ' HA ' HE22 ' B' ' 106' ' ' GLN . 88.1 mmm -124.27 54.49 1.35 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.318 -0.856 . . . . 10.0 108.99 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.529 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 39.9 tttm -132.23 -49.5 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.329 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.529 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 10.3 Cg_exo -73.02 65.57 4.15 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 122.309 2.006 . . . . 10.0 111.958 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.723 HE22 ' HA ' ' B' ' 103' ' ' MET . 1.5 mt-30 -134.72 174.97 9.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.902 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -90.87 176.96 6.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.845 0.355 . . . . 10.0 111.201 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -102.93 135.62 44.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.123 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -88.82 -143.64 9.58 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.046 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.84 -38.47 11.22 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.185 0.516 . . . . 10.0 110.722 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.679 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.3 m -76.75 159.61 30.0 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.761 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 112' ' ' ALA . . . . . 0.497 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.16 121.14 14.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 179.105 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 72.33 16.92 4.97 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.915 0.759 . . . . 10.0 111.903 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.679 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 27.0 tt0 -71.53 119.98 16.45 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.822 0.344 . . . . 10.0 110.078 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.88 122.48 33.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.834 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.437 ' HB1' HE22 ' B' ' 118' ' ' GLN . . . -106.9 103.28 12.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.883 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.515 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.5 t -90.46 101.38 12.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.52 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.437 HE22 ' HB1' ' B' ' 116' ' ' ALA . 1.7 mp0 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.78 0.324 . . . . 10.0 111.363 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.481 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.2 ttpt -110.87 117.59 33.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.707 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.53 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 31.7 mt -92.61 123.56 36.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.081 -0.509 . . . . 10.0 109.839 179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 mt -107.57 116.98 52.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.8 p -89.04 177.76 6.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.494 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 13.7 m -76.99 2.85 13.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.862 0.363 . . . . 10.0 111.658 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -102.14 3.67 38.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 10.0 110.356 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.56 12.83 84.13 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.649 -0.786 . . . . 10.0 111.398 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.6 133.94 33.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.657 0.265 . . . . 10.0 110.324 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.481 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 21.5 mt-10 -107.18 126.66 52.68 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.071 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.66 108.57 16.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.562 -0.29 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.67 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 9.4 mm -89.79 118.68 35.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.841 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 23.6 t -105.95 135.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 1.053 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 53.7 tttt -59.71 132.04 52.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 110.135 -0.321 . . . . 10.0 110.135 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 11.2 tpt180 -52.06 -37.04 52.39 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.447 0.467 . . . . 10.0 111.21 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.502 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 58.0 tt0 -54.53 -43.22 71.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.537 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -85.27 -33.36 22.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.035 0.445 . . . . 10.0 110.742 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.47 91.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.521 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 89.2 mt -58.39 -48.18 81.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.966 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -39.54 93.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.468 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -64.88 -36.7 85.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.8 -6.7 82.48 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.657 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 19.8 m -91.02 -22.1 20.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.307 0.575 . . . . 10.0 109.71 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -76.6 152.44 5.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.651 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -70.62 80.53 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.175 0.512 . . . . 10.0 110.529 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -97.36 178.15 5.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.678 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 94.3 mmm -78.5 35.39 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.981 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.57 -26.54 66.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.353 0.597 . . . . 10.0 109.606 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 4.3 m -95.54 17.65 14.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.243 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.85 -61.99 3.8 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.573 -0.739 . . . . 10.0 112.673 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.33 -174.8 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.514 2.143 . . . . 10.0 111.901 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.04 -79.21 0.15 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.986 -0.626 . . . . 10.0 112.519 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -122.24 127.71 50.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -88.65 85.17 6.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.317 0.579 . . . . 10.0 111.076 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.11 155.39 32.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.34 -25.43 49.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.996 0.739 . . . . 10.0 112.996 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.11 -39.45 90.02 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.616 -0.512 . . . . 10.0 109.616 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.532 ' O ' HG22 ' C' ' 42' ' ' VAL . 14.9 tp10 -88.84 -13.98 38.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.267 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 6.8 m -78.27 -40.26 37.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 10.0 110.191 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -75.66 -44.43 42.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.179 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -128.63 103.62 7.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.321 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.532 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.9 t -94.8 123.64 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.885 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -101.35 121.03 41.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.877 0.37 . . . . 10.0 110.892 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.562 ' HB3' HD12 ' C' ' 47' ' ' ILE . 95.3 m-85 -101.61 117.31 34.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.956 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 45' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 6.4 mmt180 -92.16 132.79 36.35 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.374 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 46' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 1.4 mp0 75.11 3.81 4.15 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.998 0.811 . . . . 10.0 112.279 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.562 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.1 mt -106.62 109.02 62.85 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.984 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.57 157.68 59.5 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.152 2.568 . . . . 10.0 112.127 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.9 p -64.78 -39.36 93.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.498 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 50' ' ' HIS . . . . . 0.426 ' HB2' ' HD3' ' A' ' 30' ' ' ARG . 6.7 m80 -52.24 -59.07 4.83 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.818 0.673 . . . . 10.0 112.818 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.467 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.7 m -64.93 -35.66 75.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 10.0 111.397 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 -33.97 77.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.804 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 26.1 m -61.92 -43.06 99.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.893 0.378 . . . . 10.0 110.547 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -66.43 -35.6 80.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.311 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' C' ' 51' ' ' VAL . 88.1 t -63.36 -47.55 91.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.09 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 36.0 m -60.29 -42.92 96.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.854 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.3 mtm -67.26 -37.27 83.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.611 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.4 t80 -65.74 -41.95 91.56 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.427 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.409 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.8 m-85 -64.72 -45.7 85.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.104 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 42.9 m -58.69 -42.35 88.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.301 0.572 . . . . 10.0 109.665 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -64.75 -43.7 92.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.143 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -62.79 -40.75 98.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.098 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.409 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.2 t -60.07 -50.48 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.1 mmt180 -68.89 -37.85 79.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.338 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 69.0 t80 -58.2 -48.24 80.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.064 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.13 7.05 23.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.67 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.85 -46.93 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.177 -0.327 . . . . 10.0 111.57 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 6.3 m -146.15 -34.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.555 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.9 m -80.74 42.5 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.296 0.48 . . . . 10.0 112.296 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.06 -7.13 57.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.241 0.543 . . . . 10.0 110.066 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -78.76 -21.54 47.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.636 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 39.7 pt -95.96 163.8 20.17 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.194 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.636 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 80.8 Cg_endo -76.99 -177.31 3.72 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.304 2.003 . . . . 10.0 112.726 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.96 169.9 13.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.009 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -54.16 128.98 58.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.556 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -50.76 129.49 27.5 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.126 2.551 . . . . 10.0 112.834 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 pt -81.65 36.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.568 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -80.08 -59.71 0.53 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.395 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 72.1 Cg_endo -79.74 119.67 4.09 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.764 1.643 . . . . 10.0 110.505 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.35 12.32 1.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 38.4 mm -78.9 75.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.408 0.623 . . . . 10.0 109.952 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -138.92 -43.21 0.47 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.119 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.413 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 13.4 tp -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.644 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.591 ' HA ' HD23 ' A' ' 32' ' ' LEU . 23.9 mp0 -60.5 -37.29 80.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.325 -0.852 . . . . 10.0 109.47 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 8' ' ' LEU . 60.3 mt -79.49 -36.64 38.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.731 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.77 -31.75 73.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.525 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.9 ttp -58.98 -25.2 63.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.915 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.15 -35.49 73.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.05 -55.2 0.56 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.293 0.849 . . . . 10.0 113.293 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -81.97 36.17 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.117 0.484 . . . . 10.0 111.14 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.695 -0.669 . . . . 10.0 109.574 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.637 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.195 -0.362 . . . . 10.0 112.195 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.448 ' CB ' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -68.0 -57.82 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.214 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.828 HD21 ' HB3' ' C' ' 85' ' ' LEU . 23.5 tp -63.12 -27.85 69.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.933 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -55.51 -35.09 65.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.265 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -95.36 -37.33 11.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.329 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 95.0 mt -63.07 -36.85 84.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.385 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.8 88.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.349 . . . . 10.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.3 tp -68.6 -30.03 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.279 0.561 . . . . 10.0 109.547 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.43 -8.89 59.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.52 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.15 -35.69 11.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.171 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.669 ' HA ' HG22 ' C' ' 77' ' ' ILE . 3.7 tp -163.56 122.38 2.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.172 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.0 mt -82.55 92.65 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 79.5 tttt -104.45 107.21 57.16 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.44 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -95.29 52.62 0.2 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.325 2.684 . . . . 10.0 111.173 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 69.1 mttt -108.87 174.82 5.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.874 -179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -80.47 143.02 33.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.739 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -100.24 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.074 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.094 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER -120.88 136.24 25.38 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.416 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.7 Cg_exo -34.5 133.49 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.147 3.231 . . . . 10.0 113.624 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.695 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 29.2 Cg_endo -62.98 138.23 66.78 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.0 2.467 . . . . 10.0 112.442 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -71.48 125.76 91.76 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.376 179.38 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -61.13 -22.33 74.35 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.224 2.616 . . . . 10.0 113.198 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -35.89 82.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.051 0.453 . . . . 10.0 111.074 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 t -120.07 -132.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.86 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.0 ptp180 -158.98 52.66 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.112 0.482 . . . . 10.0 111.258 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 14.9 tttm -149.57 148.44 29.36 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.695 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.65 148.9 44.35 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.83 0.347 . . . . 10.0 110.681 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -91.4 172.93 8.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.075 -179.108 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.457 ' H ' HG22 ' A' ' 33' ' ' THR . 6.7 mt-10 -117.16 113.59 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.399 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.094 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.4 t70 -156.57 -81.64 0.07 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 -62.62 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.9 m0 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.54 179.654 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 mmm . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.949 0.404 . . . . 10.0 110.801 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.77 122.95 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.922 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.415 HG11 HD13 ' B' ' 57' ' ' LEU . 93.3 t -123.65 116.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.107 0.48 . . . . 10.0 111.095 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.47 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 44.7 m-85 -105.08 110.97 23.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.551 -0.75 . . . . 10.0 109.473 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.67 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -124.56 154.63 40.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.991 0.425 . . . . 10.0 111.646 -179.289 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.596 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 53.9 mtm -122.77 104.87 9.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.334 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.496 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.4 mm -78.2 107.25 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.912 -0.773 . . . . 10.0 108.912 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -109.95 104.4 13.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.866 0.691 . . . . 10.0 112.866 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.456 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 27.8 ttp85 -89.03 67.43 8.1 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.595 -1.261 . . . . 10.0 107.595 177.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.549 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.1 t-160 67.77 -76.69 0.05 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.174 -0.921 . . . . 10.0 111.485 -178.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.407 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 72.3 mmtt -110.01 -9.35 14.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.483 -0.326 . . . . 10.0 111.382 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.8 m -105.2 99.59 9.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.062 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.2 m -101.17 125.53 47.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.923 0.392 . . . . 10.0 111.019 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 40.2 mt -121.52 121.85 65.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.313 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' PHE . . . . . 0.47 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 62.3 t80 -79.6 121.69 25.58 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.67 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.0 m -114.7 119.82 38.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.089 0.471 . . . . 10.0 111.452 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.678 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.9 t70 -103.31 103.68 13.72 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.207 -1.034 . . . . 10.0 108.207 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' ALA . . . . . 0.466 ' O ' ' HD3' ' B' ' 19' ' ' LYS . . . -130.64 -166.66 1.72 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.653 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.466 ' HD3' ' O ' ' B' ' 18' ' ' ALA . 20.7 mmtt -128.88 165.5 20.92 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.754 -0.462 . . . . 10.0 109.754 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.401 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 16.9 mp0 -61.52 -28.46 69.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.649 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 m -69.13 -21.49 64.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.85 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 2.3 m -73.75 145.23 45.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.743 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.5 p -94.34 162.97 13.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.761 0.315 . . . . 10.0 111.033 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.517 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 97.4 t -64.89 -34.03 67.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.133 0.492 . . . . 10.0 109.992 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -62.56 -34.99 78.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.406 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -68.24 -33.37 74.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.906 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.77 HD11 HD21 ' B' ' 57' ' ' LEU . 87.1 mt -62.15 -43.71 98.24 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.735 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.1 mttt -62.23 -33.81 75.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.237 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtp180 -66.2 -40.44 90.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.512 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.61 -46.8 91.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.835 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.98 -36.84 77.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.673 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.628 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.4 tm-20 -56.5 -43.39 79.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.34 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.88 -18.02 78.74 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -94.08 -57.29 4.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.774 0.321 . . . . 10.0 111.528 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.588 HD21 HG21 ' B' ' 12' ' ' THR . 22.1 mt -76.87 -14.19 59.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.3 mttt 64.75 31.61 11.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.373 0.606 . . . . 10.0 110.994 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.402 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 62.8 mtt-85 -123.42 135.08 25.67 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.856 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 74.7 Cg_exo -53.07 138.82 62.61 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 123.384 2.723 . . . . 10.0 113.028 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.735 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 13.9 Cg_exo -70.82 -12.53 31.03 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.831 2.354 . . . . 10.0 111.19 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.15 -45.66 75.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.204 -0.907 . . . . 10.0 112.134 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -99.83 16.76 22.68 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -88.04 123.45 32.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.816 0.341 . . . . 10.0 110.849 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' B' ' 43' ' ' ARG . 39.7 mmt-85 -116.1 111.86 20.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.11 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -96.01 120.39 36.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.402 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -113.75 127.8 56.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.496 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.0 tttm -135.49 137.26 41.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 48' ' ' ASP . 4.7 m-20 62.44 25.26 15.06 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.347 0.405 . . . . 10.0 110.379 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 48' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 47' ' ' ASP . 78.6 m-20 75.18 4.32 4.16 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.404 -0.816 . . . . 10.0 112.239 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -119.54 163.11 17.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.069 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.0 tp -79.97 141.14 36.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.544 0.211 . . . . 10.0 110.689 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -80.37 155.58 27.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.318 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -98.92 115.37 28.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.859 0.361 . . . . 10.0 111.199 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.517 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 78.4 m-20 -60.33 -29.37 68.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.639 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 3.84 75.88 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.003 -0.617 . . . . 10.0 113.485 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -118.02 163.53 16.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.066 0.46 . . . . 10.0 111.017 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.5 p -92.25 170.44 9.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.896 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.77 HD21 HD11 ' B' ' 27' ' ' LEU . 34.7 mt -62.26 -41.91 98.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.904 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.73 -40.58 95.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.09 -0.576 . . . . 10.0 112.512 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -72.27 -21.16 61.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 10.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 70.2 m -89.47 3.17 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.009 0.433 . . . . 10.0 111.646 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.61 2.72 63.1 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.724 -0.751 . . . . 10.0 113.293 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.496 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 57.5 m-85 -75.77 96.85 3.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.05 0.425 . . . . 10.0 110.171 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 55.1 p -114.94 164.55 13.98 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 20.0 m -72.52 -2.45 19.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.304 0.573 . . . . 10.0 110.476 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -90.17 -49.42 6.57 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.642 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -35.02 55.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.043 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.11 103.69 12.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.526 ' HB3' ' HG3' ' B' ' 70' ' ' GLN . 16.3 mtm180 -119.31 163.07 28.81 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.731 -178.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.409 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 32.8 Cg_endo -66.78 -14.88 45.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.043 1.829 . . . . 10.0 110.531 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -103.76 -1.62 27.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.169 -0.923 . . . . 10.0 110.104 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.729 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.63 84.17 1.35 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.438 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.9 Cg_exo -76.87 136.41 16.68 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.855 2.37 . . . . 10.0 111.837 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 122.19 17.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.418 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -80.81 124.69 29.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.948 0.404 . . . . 10.0 111.448 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.496 ' HB ' HD13 ' B' ' 7' ' ' ILE . 39.6 t -117.87 125.92 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.95 126.85 7.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.768 -0.73 . . . . 10.0 111.91 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.54 111.17 22.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.719 0.295 . . . . 10.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -107.29 128.91 54.87 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.669 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -105.04 116.58 32.19 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.229 -0.285 . . . . 10.0 110.229 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -76.75 85.5 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.581 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -96.72 131.42 43.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.77 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.79 140.22 58.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.28 7.4 4.87 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.982 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.8 m -117.87 104.59 11.08 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -76.68 0.36 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 10.0 112.061 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.1 tt0 -57.12 -32.22 66.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.04 0.448 . . . . 10.0 110.657 179.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.23 -26.24 67.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.747 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.8 mt -75.66 -26.29 57.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.831 0.348 . . . . 10.0 111.005 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 22.4 m -83.61 -32.32 25.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' B' ' 10' ' ' HIS . 17.6 mt -81.78 -27.09 9.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.388 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -70.01 110.51 6.8 Favored Pre-proline 0 C--O 1.234 0.284 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.314 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.617 ' HA ' ' O ' ' B' ' 95' ' ' SER . 15.4 Cg_exo -69.88 -8.89 24.74 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.544 2.829 . . . . 10.0 112.531 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.842 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.9 m -99.0 -44.68 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.236 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.617 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 13.0 m -107.48 144.35 29.05 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.067 -179.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 159.84 47.42 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.595 2.197 . . . . 10.0 111.576 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.22 128.07 21.79 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.559 2.172 . . . . 10.0 111.473 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.76 106.84 3.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.101 0.476 . . . . 10.0 111.668 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 35.1 tp -129.78 120.71 19.65 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.188 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -51.43 120.31 6.73 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.755 2.303 . . . . 10.0 111.761 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.01 -33.7 71.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.427 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.14 -15.32 18.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.808 0.337 . . . . 10.0 111.347 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 67.5 mmm -115.22 21.28 14.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.412 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.447 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 50.3 tttm -96.41 -51.08 0.23 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 113.565 0.95 . . . . 10.0 113.565 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.447 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 56.5 Cg_endo -71.62 82.87 1.12 Allowed 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.145 1.897 . . . . 10.0 112.743 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -161.03 -171.69 3.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.689 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.49 ' HB2' HE22 ' B' ' 118' ' ' GLN . 5.5 t0 -104.83 174.99 5.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.916 0.389 . . . . 10.0 111.215 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -100.99 157.12 16.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.49 -129.99 5.1 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.678 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 10.5 m -110.93 -31.09 7.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.093 0.473 . . . . 10.0 110.024 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.729 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 51.0 m -86.53 170.76 11.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.932 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.47 134.04 36.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.1 t30 70.59 7.38 6.19 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.555 0.535 . . . . 10.0 111.032 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 50.7 tt0 -84.9 121.06 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -108.87 151.78 25.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.741 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -128.81 103.81 7.27 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.477 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.586 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.1 t -67.7 134.29 30.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' B' ' 107' ' ' ASP . 12.6 mp0 . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.183 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.061 0.457 . . . . 10.0 110.841 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -105.25 115.86 30.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.452 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.474 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 25.2 mt -90.63 133.29 35.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.882 -0.784 . . . . 10.0 108.882 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 13.3 mt -118.6 113.63 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.762 -0.199 . . . . 10.0 110.691 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.15 161.33 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -20.98 64.78 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.256 0.465 . . . . 10.0 112.256 -179.418 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -74.15 -10.48 59.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.704 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.16 39.25 8.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.595 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -111.73 140.95 45.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.719 0.295 . . . . 10.0 110.265 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.611 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.3 mt-10 -99.86 128.64 45.94 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.495 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 65.6 m-85 -127.69 96.73 4.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.95 0.405 . . . . 10.0 110.531 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.55 116.48 34.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.001 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.5 t -100.54 141.5 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.823 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.678 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 75.3 tttt -55.98 130.09 42.44 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.169 0.293 . . . . 10.0 110.237 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.649 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 63.4 ttt180 -54.6 -34.8 62.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.702 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -56.49 -46.85 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.154 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -74.65 -31.95 62.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.15 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.44 68.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.909 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 55.4 mt -58.75 -56.82 17.3 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.151 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -65.9 -31.39 72.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.716 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 43.9 m -65.32 -33.27 75.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 10.0 109.922 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.17 -12.82 82.8 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.128 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.09 -12.5 57.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.389 0.614 . . . . 10.0 110.029 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 45.5 mt -90.71 146.69 5.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.813 -0.81 . . . . 10.0 108.813 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.33 76.52 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.438 0.637 . . . . 10.0 111.102 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' SER . . . -85.55 -174.21 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.094 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.637 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.7 mmm -79.12 37.36 0.31 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mp -69.8 -32.64 71.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.16 13.96 19.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.17 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 30' ' ' GLY . . . . . 0.428 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -75.97 -56.3 4.5 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.633 -0.712 . . . . 10.0 113.109 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 31' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 42.0 Cg_endo -66.73 179.63 2.09 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.661 2.241 . . . . 10.0 112.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.28 -46.77 14.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.698 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -141.76 104.68 4.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.766 0.317 . . . . 10.0 110.606 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -87.02 89.61 8.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.98 0.419 . . . . 10.0 110.602 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.98 174.91 8.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.569 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.23 -25.85 68.25 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.673 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -58.98 -43.28 91.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.054 0.454 . . . . 10.0 109.779 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.7 mp0 -75.34 -18.49 59.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.822 179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.9 m -78.57 -30.32 46.75 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -81.68 -50.88 8.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.661 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.18 107.13 9.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.8 t -94.55 103.77 15.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.455 -179.263 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -89.39 122.68 32.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.036 0.446 . . . . 10.0 111.053 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.702 ' HB3' HD12 ' C' ' 47' ' ' ILE . 86.5 m-85 -103.62 144.03 31.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.632 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -113.65 132.52 55.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.507 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 61.02 28.94 18.68 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.694 0.621 . . . . 10.0 112.663 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.702 HD12 ' HB3' ' C' ' 44' ' ' PHE . 83.7 mt -121.82 103.08 40.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.587 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.447 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 48.7 Cg_exo -57.5 140.28 92.77 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.092 2.528 . . . . 10.0 113.097 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -59.61 -36.1 75.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.278 -0.873 . . . . 10.0 111.093 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -51.22 70.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.43 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.1 m -70.85 -29.21 36.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.95 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 tp -66.37 -36.91 84.08 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -61.98 -33.94 75.24 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.139 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 13.4 tptp -65.42 -39.93 92.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.571 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -67.24 -46.52 83.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.933 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 76.5 m -58.21 -42.87 87.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.428 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.2 mtm -64.9 -39.52 93.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.815 0.34 . . . . 10.0 110.884 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -67.48 -39.06 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.379 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -64.22 -46.5 83.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.06 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 31.5 m -59.19 -42.1 90.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.374 0.607 . . . . 10.0 109.782 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.409 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 14.5 t80 -66.56 -43.48 84.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.39 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -63.62 -38.77 92.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.492 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.35 -47.44 92.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.986 0.422 . . . . 10.0 110.253 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.867 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 16.3 t80 -58.21 -45.08 88.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.639 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -87.31 21.54 2.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.202 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -131.4 -47.82 0.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.085 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.22 -39.87 0.4 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.011 0.375 . . . . 10.0 112.011 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.57 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -76.53 39.67 0.21 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.04 -11.03 45.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.126 0.488 . . . . 10.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -92.57 4.82 52.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.42 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 pt -118.25 156.38 50.76 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.186 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.69 159.72 16.43 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.2 2.6 . . . . 10.0 112.999 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 13.4 tp10 -69.09 171.08 8.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.215 -0.902 . . . . 10.0 109.597 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.411 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 36.4 t80 -47.91 130.76 11.76 Favored Pre-proline 0 C--O 1.233 0.19 0 O-C-N 123.291 0.369 . . . . 10.0 110.923 179.57 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -53.09 111.8 0.76 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.078 2.519 . . . . 10.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.1 pt -76.75 61.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.371 0.605 . . . . 10.0 111.18 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -114.67 -53.3 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.587 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 24.8 Cg_exo -64.11 119.72 6.85 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.948 1.765 . . . . 10.0 111.486 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.78 -14.58 46.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.404 0.52 . . . . 10.0 112.404 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -79.62 98.67 3.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.046 0.451 . . . . 10.0 110.471 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.08 -43.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.648 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.466 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.9 tp -67.18 -24.28 65.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.551 ' HA ' HD23 ' A' ' 32' ' ' LEU . 32.9 mp0 -62.88 -29.65 70.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.985 -1.007 . . . . 10.0 109.779 178.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.828 ' HB3' HD21 ' A' ' 8' ' ' LEU . 50.1 mt -77.01 -32.45 57.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.452 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -21.41 63.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.984 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.0 ttp -66.1 -18.74 65.54 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.663 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.95 -33.18 75.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.776 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.72 -61.28 0.37 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.985 0.803 . . . . 10.0 112.933 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -82.65 45.95 1.03 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.903 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.598 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.7 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.097 -0.705 . . . . 10.0 109.097 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 112.145 -0.382 . . . . 10.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.443 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.23 -55.9 18.39 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -60.37 -30.47 69.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -178.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.69 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 31.1 mt-30 -58.12 -32.68 68.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 10.0 111.042 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -96.95 -40.8 8.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.001 0.429 . . . . 10.0 110.426 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.519 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.9 mt -60.27 -42.7 95.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.16 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.23 64.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.727 0.298 . . . . 10.0 111.082 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.2 tp -63.83 -40.06 95.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.023 0.44 . . . . 10.0 110.422 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -14.15 59.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.955 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.9 -24.16 20.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.776 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 2.7 tp -164.54 110.37 1.0 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 10.0 111.835 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.2 mt -84.31 88.02 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.625 ' HB3' HD22 ' C' ' 83' ' ' LEU . 83.7 tttt -96.1 106.65 29.83 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.836 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 3.4 Cg_endo -88.23 60.32 3.02 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.546 2.831 . . . . 10.0 112.092 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -126.91 167.28 16.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -79.32 151.97 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.24 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.631 HD11 HD23 ' C' ' 83' ' ' LEU . 48.2 mm -113.47 100.02 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.906 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 36.6 tttp -107.63 138.26 19.94 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.41 133.12 0.16 Allowed 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.756 2.97 . . . . 10.0 113.422 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.916 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.0 Cg_endo -53.42 151.85 22.26 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.898 3.065 . . . . 10.0 114.281 -178.403 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mp -81.07 122.36 81.59 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.641 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -59.19 -26.21 80.91 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.274 2.649 . . . . 10.0 113.091 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -35.96 78.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.62 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.431 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 4.3 m -118.59 -145.53 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.763 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 2.5 ptp180 -143.29 53.8 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.381 0.61 . . . . 10.0 110.634 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.6 tttm -150.38 150.28 31.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.026 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.916 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -76.04 156.12 34.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 10.0 110.806 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.58 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -90.05 152.11 21.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.668 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -107.35 106.16 16.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.861 0.362 . . . . 10.0 110.509 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.906 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 t70 -164.36 -72.58 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.114 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.28 -69.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.143 -0.932 . . . . 10.0 109.4 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.855 0.359 . . . . 10.0 110.508 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.12 136.15 39.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.824 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.41 HG11 HD13 ' B' ' 57' ' ' LEU . 52.6 t -124.97 124.46 67.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.165 0.507 . . . . 10.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.46 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.9 m-85 -113.74 111.7 22.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.735 179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.738 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -126.32 156.15 40.88 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.962 0.411 . . . . 10.0 111.66 -179.779 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.651 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 67.3 mtm -124.2 107.77 11.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.313 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.55 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -80.56 109.45 15.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -105.74 105.89 16.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.162 0.431 . . . . 10.0 112.162 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.513 ' HB2' HD23 ' B' ' 77' ' ' LEU . 10.0 ttp85 -104.6 95.42 5.9 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 177.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 66.13 -88.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.622 0.577 . . . . 10.0 109.691 -178.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -129.16 11.4 5.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.321 0.581 . . . . 10.0 110.434 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 4.2 m -106.45 99.08 8.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.293 178.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' B' ' 7' ' ' ILE . 30.9 m -100.68 126.29 47.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.903 0.382 . . . . 10.0 111.083 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.626 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.7 mt -114.66 119.64 62.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.581 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -76.91 117.42 18.5 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.311 -0.625 . . . . 10.0 109.311 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.738 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -112.23 109.82 19.72 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.815 0.672 . . . . 10.0 112.815 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.589 ' HB3' ' CD ' ' C' ' 14' ' ' LYS . 3.7 t70 -97.05 106.87 19.29 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.322 -1.362 . . . . 10.0 107.322 177.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.31 -168.86 2.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.905 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -124.89 161.02 27.48 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' B' ' 56' ' ' THR . 49.6 mt-10 -59.67 -27.1 66.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 10.0 111.74 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.56 -17.79 63.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.695 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.9 m -78.39 134.7 37.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.878 0.371 . . . . 10.0 110.781 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.1 p -85.13 167.26 15.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.197 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.85 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 93.3 t -63.39 -35.82 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 10.0 110.761 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 55.8 t80 -65.33 -33.34 75.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.638 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -65.74 -30.03 70.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.83 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.948 HD11 HD21 ' B' ' 57' ' ' LEU . 64.0 mt -66.8 -42.78 85.39 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.804 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.8 mttt -62.23 -31.57 72.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.212 -0.904 . . . . 10.0 110.526 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -64.59 -41.3 96.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.769 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.69 -43.4 93.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.96 -35.52 73.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.154 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.545 ' HB2' ' HG3' ' B' ' 39' ' ' PRO . 24.4 tt0 -60.97 -41.11 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.02 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.93 -20.88 79.71 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.04 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.9 mt -93.77 -49.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 23.8 mt -84.58 -14.84 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.334 0.494 . . . . 10.0 112.334 -178.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 63.74 32.02 13.92 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.12 0.486 . . . . 10.0 111.696 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -126.35 146.27 55.72 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.866 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.527 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 51.0 Cg_exo -56.71 133.01 55.28 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.418 2.745 . . . . 10.0 113.554 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.804 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 17.2 Cg_exo -70.3 -17.35 35.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.539 2.826 . . . . 10.0 112.165 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -65.51 -31.57 72.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.572 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.478 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 31.8 mm-40 -90.94 -1.72 57.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.644 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -89.28 126.34 35.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.37 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.511 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 21.9 mmt180 -116.41 113.63 23.13 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 48.4 mt -92.31 114.76 27.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.859 0.361 . . . . 10.0 111.18 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -110.65 115.75 30.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.795 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.613 ' HB3' HD21 ' B' ' 51' ' ' LEU . 13.4 tmtt? -129.09 135.96 49.6 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.259 -1.015 . . . . 10.0 108.259 179.022 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 65.61 32.67 9.06 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.48 0.488 . . . . 10.0 110.627 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.73 13.9 9.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.523 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -135.01 165.9 24.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.729 0.299 . . . . 10.0 110.73 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 tp -82.58 140.43 33.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.583 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.613 HD21 ' HB3' ' B' ' 46' ' ' LYS . 94.3 mt -87.87 146.25 25.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -88.43 113.76 24.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.64 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.85 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 90.4 m-20 -56.96 -29.68 63.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.125 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -76.49 -6.2 83.8 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.592 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -108.77 161.47 15.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.006 0.403 . . . . 10.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -87.4 169.4 12.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.5 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.948 HD21 HD11 ' B' ' 27' ' ' LEU . 51.5 mt -60.4 -43.5 96.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.189 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -55.27 -45.32 83.33 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.132 -0.556 . . . . 10.0 112.741 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -66.08 -28.93 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.111 0.412 . . . . 10.0 112.111 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' CYS . . . . . 0.442 ' HB3' HD22 ' B' ' 51' ' ' LEU . 56.4 m -83.79 11.14 7.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 10.0 112.101 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.87 49.12 7.27 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.763 -0.732 . . . . 10.0 112.777 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 36.6 m-85 -118.48 57.18 0.86 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.169 0.509 . . . . 10.0 110.317 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 14.3 p -76.71 161.6 28.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.728 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.2 p -64.55 -20.04 65.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.489 . . . . 10.0 111.952 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -78.32 -26.98 47.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.778 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -46.04 9.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.065 0.46 . . . . 10.0 109.869 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.46 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -104.1 105.49 15.68 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.54 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.458 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 68.1 mtt180 -116.39 161.13 33.15 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.222 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.584 ' HB3' ' HG3' ' C' ' 64' ' ' ARG . 27.5 Cg_endo -64.58 -19.07 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.219 1.946 . . . . 10.0 110.602 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.57 6.35 34.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.023 -0.989 . . . . 10.0 110.471 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.533 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -167.52 85.6 0.78 Allowed Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.925 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.651 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.7 Cg_exo -77.93 147.63 24.29 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.916 2.411 . . . . 10.0 111.669 179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.76 117.79 22.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.09 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 130.39 39.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.031 0.443 . . . . 10.0 111.622 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.55 ' HB ' HD13 ' B' ' 7' ' ' ILE . 43.9 t -124.36 132.41 71.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.05 129.37 9.03 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.846 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.513 HD23 ' HB2' ' B' ' 9' ' ' ARG . 39.3 tp -110.35 102.14 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.981 0.42 . . . . 10.0 111.962 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.511 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.12 132.61 37.1 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.372 -0.973 . . . . 10.0 108.372 178.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.478 ' CE1' ' HB2' ' B' ' 41' ' ' GLU . 52.1 t80 -117.07 119.1 34.22 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.848 -0.341 . . . . 10.0 111.398 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -70.76 117.52 12.38 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.997 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -131.23 149.96 52.35 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.395 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -76.58 126.13 30.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.665 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.87 -35.95 0.32 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.77 0.669 . . . . 10.0 112.567 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 0.2 OUTLIER -74.8 94.63 2.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.869 0.366 . . . . 10.0 110.199 179.185 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -79.24 16.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.909 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.47 ' O ' HG13 ' B' ' 90' ' ' ILE . 34.5 tt0 -61.33 -25.81 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.696 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.48 67.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.699 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.37 -41.62 98.77 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -79.19 -7.85 58.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.47 HG13 ' O ' ' B' ' 86' ' ' GLU . 8.0 mt -106.25 -0.52 9.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.481 0.658 . . . . 10.0 110.035 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.84 106.71 45.59 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.599 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.4 Cg_exo -65.83 -12.27 34.52 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.164 2.576 . . . . 10.0 112.146 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -76.6 -25.17 53.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.619 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -116.48 -32.77 5.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.599 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.0 m -125.03 146.97 55.36 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.483 0.183 . . . . 10.0 110.971 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.07 153.57 57.45 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 122.413 2.075 . . . . 10.0 111.539 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.61 133.67 40.69 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.715 2.276 . . . . 10.0 112.466 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.62 123.8 24.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.436 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.481 HD12 ' HD2' ' B' ' 100' ' ' PRO . 22.9 tp -147.25 128.76 7.31 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.408 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.481 ' HD2' HD12 ' B' ' 99' ' ' LEU . 10.9 Cg_endo -55.64 124.14 15.56 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.702 2.268 . . . . 10.0 111.564 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.86 -28.68 69.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.29 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.0 m -68.96 -12.49 16.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.147 0.499 . . . . 10.0 110.811 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.467 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 81.4 mmm -120.89 22.34 11.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.773 -0.648 . . . . 10.0 109.734 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -91.48 -51.18 0.31 Allowed Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.5 68.41 6.16 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.349 2.032 . . . . 10.0 112.244 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.467 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 61.4 mt-30 -132.48 -177.71 4.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.37 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' B' ' 118' ' ' GLN . 2.4 t0 -96.81 169.46 9.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.515 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 135.02 37.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.74 -147.67 7.94 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.972 -0.632 . . . . 10.0 113.372 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -99.27 -26.88 14.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.934 0.397 . . . . 10.0 110.89 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.437 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 21.0 m -91.41 163.92 14.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.269 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 112' ' ' ALA . . . . . 0.533 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.45 125.36 25.88 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.676 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.3 t30 70.0 16.01 7.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.508 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 3.1 tt0 -81.3 135.35 35.7 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.98 138.4 52.2 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.098 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.53 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -116.54 116.31 27.38 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.616 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.557 ' H ' HD11 ' C' ' 81' ' ' ILE . 1.7 t -77.86 143.45 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.151 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.473 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 24.8 mp0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.731 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.983 0.421 . . . . 10.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.706 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 37.0 ttpt -115.12 128.37 56.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.132 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.665 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 34.2 mt -96.37 125.11 40.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.842 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -102.02 117.41 47.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.637 0.256 . . . . 10.0 110.597 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -86.86 161.33 18.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.837 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.47 -24.67 67.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.316 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.31 8.66 8.6 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.694 0.283 . . . . 10.0 111.176 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.05 43.82 25.47 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 110.774 -0.93 . . . . 10.0 110.774 -179.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -113.53 141.48 47.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.264 . . . . 10.0 110.451 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.706 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 37.2 mt-10 -112.27 131.43 55.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.236 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' C' ' 2' ' ' LYS . 38.5 m-85 -124.1 104.73 9.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.652 179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.626 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 8.9 mm -87.16 115.08 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -101.13 129.39 52.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 110.092 -0.336 . . . . 10.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.589 ' CD ' ' HB3' ' B' ' 17' ' ' ASP . 77.3 tttt -59.47 128.33 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.613 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 44.6 ttt180 -50.74 -35.96 34.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.47 0.545 . . . . 10.0 112.47 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -50.45 -46.67 56.78 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.333 0.396 . . . . 10.0 111.735 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -85.83 -27.71 24.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.164 0.507 . . . . 10.0 110.717 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 18' ' ' ALA . . . . . 0.426 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -66.41 -29.26 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 96.0 mt -63.5 -49.04 75.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 10.0 110.215 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.596 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -66.18 -40.22 90.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.622 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 18.9 m -63.5 -35.34 80.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.081 0.467 . . . . 10.0 110.459 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.64 -5.0 85.87 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.068 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 10.1 m -89.22 -27.23 20.76 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.359 0.6 . . . . 10.0 109.81 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 12.6 mt -75.65 153.3 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.678 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.11 85.34 1.03 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.089 0.471 . . . . 10.0 110.433 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.443 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -97.32 177.45 5.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.066 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.9 mmm -80.71 35.31 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.151 0.426 . . . . 10.0 112.151 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mp -69.06 -28.74 66.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.246 0.546 . . . . 10.0 109.9 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.37 14.33 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.05 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 30' ' ' GLY . . . . . 0.424 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -74.78 -58.99 3.88 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.749 -0.66 . . . . 10.0 112.84 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 31' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 29.0 Cg_endo -62.95 166.16 14.84 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.556 2.17 . . . . 10.0 112.246 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -49.1 79.0 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.831 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -147.57 115.04 6.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.698 0.285 . . . . 10.0 110.564 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -85.03 91.46 8.09 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.867 -0.419 . . . . 10.0 109.867 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.6 166.69 23.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.575 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.13 -32.12 73.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.619 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -63.94 -38.28 90.49 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.563 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.1 tp10 -72.24 -24.32 61.36 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.91 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -74.96 -30.38 61.19 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -84.32 -52.96 5.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.26 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.535 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 50.5 mt-10 -124.94 100.36 6.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.904 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.563 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -85.01 114.93 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.986 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -93.17 114.74 27.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.96 0.41 . . . . 10.0 111.117 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.665 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 71.9 m-85 -93.68 151.93 19.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.881 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -125.05 130.44 52.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.829 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 69.74 8.54 6.77 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.815 -0.63 . . . . 10.0 112.083 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.469 ' HA ' ' HD3' ' C' ' 48' ' ' PRO . 61.4 mt -105.44 114.58 63.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.692 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 11.8 Cg_exo -73.06 142.78 34.99 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.931 2.421 . . . . 10.0 111.708 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.7 p -60.9 -33.37 73.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.66 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -51.9 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.936 -0.574 . . . . 10.0 111.667 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.58 ' HB ' HD21 ' C' ' 85' ' ' LEU . 26.7 m -78.67 -27.65 14.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.721 0.296 . . . . 10.0 111.268 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 40.3 tp -65.79 -32.88 74.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.074 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 84.5 p -61.28 -39.3 89.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.637 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -65.93 -32.83 74.55 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.655 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.07 -47.64 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 10.9 m -62.93 -40.07 96.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.797 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 54.8 ttm -63.26 -45.74 90.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.252 -0.885 . . . . 10.0 110.431 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.519 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.4 t80 -63.52 -41.76 98.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.45 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.1 m-85 -61.88 -45.07 95.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.379 179.217 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 51.4 m -59.98 -42.12 93.49 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.304 0.574 . . . . 10.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.51 -41.63 96.3 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.404 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 tptt -63.11 -39.27 94.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.18 -0.464 . . . . 10.0 111.042 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.596 HG22 ' HB ' ' C' ' 20' ' ' THR . 71.1 t -59.2 -48.42 86.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.126 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.584 ' HG3' ' HB3' ' B' ' 69' ' ' PRO . 13.4 mmt180 -70.7 -41.01 72.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.157 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.694 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 78.4 t80 -57.61 -43.74 84.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.257 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 24.99 2.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.144 0.497 . . . . 10.0 111.267 -179.433 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -135.53 -58.52 0.78 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.627 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.39 -28.8 2.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.322 0.49 . . . . 10.0 112.322 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.694 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.2 m -86.93 32.93 0.66 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.37 5.48 20.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 10.0 111.048 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -103.69 -3.38 25.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.963 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.765 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.0 pt -111.36 167.23 9.37 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.118 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.765 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.1 Cg_endo -72.74 170.86 18.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.39 2.06 . . . . 10.0 113.08 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.7 tp10 -70.01 168.15 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.565 -0.743 . . . . 10.0 109.609 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.466 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 38.4 t80 -51.64 134.61 35.39 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 123.202 0.314 . . . . 10.0 110.647 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.7 121.52 8.12 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.067 2.511 . . . . 10.0 112.718 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 26.6 pt -84.25 44.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.799 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -101.64 -53.94 0.14 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 112.768 0.655 . . . . 10.0 112.768 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 21.4 Cg_exo -66.96 112.71 2.56 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.087 1.858 . . . . 10.0 112.598 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.487 ' HA ' HD21 ' A' ' 16' ' ' LEU . 45.1 mt-10 -75.07 55.48 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.335 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 81' ' ' ILE . . . . . 0.557 HD11 ' H ' ' B' ' 117' ' ' VAL . 13.2 mm -120.36 -11.7 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 10.0 111.253 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.776 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.11 -40.36 82.57 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.631 HD23 HD11 ' A' ' 22' ' ' ILE . 6.5 tp -67.44 -30.73 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 10.0 110.282 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.437 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 9.4 mp0 -62.33 -35.95 80.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.877 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.758 ' HB3' HD21 ' A' ' 8' ' ' LEU . 75.2 mt -76.39 -31.58 58.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.845 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.9 tt -64.71 -27.49 68.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.351 -0.841 . . . . 10.0 110.614 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 87' ' ' MET . . . . . 0.517 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 19.8 ttp -60.51 -19.18 56.14 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.904 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.94 -34.19 74.33 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.689 -0.232 . . . . 10.0 111.106 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.69 -57.64 0.5 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.208 0.818 . . . . 10.0 113.208 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -81.91 38.6 0.53 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.954 0.407 . . . . 10.0 111.657 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.528 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 1.6 t80 . . . . . 0 C--O 1.244 0.806 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.606 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.578 -0.209 . . . . 10.0 112.578 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -59.22 4.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.743 0.646 . . . . 10.0 112.743 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.8 tp -62.04 -31.77 72.21 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.891 0.377 . . . . 10.0 110.836 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.606 HE21 ' N ' ' A' ' 6' ' ' GLY . 7.3 tt0 -56.34 -33.85 66.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.786 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -97.27 -40.36 8.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.891 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.57 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.6 mt -60.61 -39.33 87.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.953 -0.567 . . . . 10.0 112.441 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.43 -36.58 81.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 10.0 111.155 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 tp -69.89 -37.3 75.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.178 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.46 -22.03 61.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.352 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.54 -51.49 7.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.087 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.0 tp -141.61 112.92 7.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.524 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.557 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 26.7 mt -80.63 93.53 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.22 -1.03 . . . . 10.0 108.22 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.416 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 85.5 tttt -106.19 94.15 9.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.678 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.557 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 3.0 Cg_endo -87.19 88.98 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.995 2.463 . . . . 10.0 110.683 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -138.43 -176.79 4.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.992 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -89.11 158.94 17.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.192 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.3 mm -100.68 162.45 3.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.406 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.9 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 1.5 tmtm? -177.75 128.14 0.3 Allowed Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.9 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 64.9 Cg_exo -39.44 138.07 0.84 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.739 2.959 . . . . 10.0 113.421 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.705 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.2 Cg_endo -57.74 138.14 84.61 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.965 2.444 . . . . 10.0 112.211 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 14.0 mt -71.53 121.74 85.22 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 24.0 Cg_endo -62.38 -23.63 75.23 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.886 2.391 . . . . 10.0 112.248 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -35.38 77.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.247 0.546 . . . . 10.0 109.975 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -116.07 -132.78 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.355 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -160.75 52.69 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.327 0.584 . . . . 10.0 109.989 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.6 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 15.0 tttm -154.6 149.32 26.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.843 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.705 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.7 pp -73.77 156.08 38.21 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.506 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -171.52 1.99 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.502 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -130.38 129.11 42.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.815 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -169.28 -63.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.073 0.463 . . . . 10.0 110.609 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.79 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-N 114.757 -1.11 . . . . 10.0 109.006 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tmm? . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.568 0.223 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.98 137.03 33.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.309 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.463 HG11 HD13 ' B' ' 57' ' ' LEU . 88.5 t -125.3 124.93 68.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.124 0.488 . . . . 10.0 111.263 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.739 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 61.8 m-85 -111.54 112.84 24.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.142 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.801 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -131.43 163.01 28.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.798 0.333 . . . . 10.0 111.191 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.7 mtm -128.54 108.27 10.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.2 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.43 HD13 ' HB ' ' B' ' 75' ' ' VAL . 49.7 mm -81.62 98.99 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.44 -0.948 . . . . 10.0 108.44 178.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.547 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.0 ttt180 -98.58 103.54 15.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 113.016 0.747 . . . . 10.0 113.016 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.5 ' HB2' HD23 ' B' ' 77' ' ' LEU . 27.5 ttp85 -89.27 72.09 8.16 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.102 -1.444 . . . . 10.0 107.102 177.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 67.87 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.058 -0.974 . . . . 10.0 110.139 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -107.94 -12.6 15.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.799 0.333 . . . . 10.0 111.108 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.481 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -95.65 91.75 6.27 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.094 -0.336 . . . . 10.0 110.094 179.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 5.2 m -94.57 120.24 34.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.005 0.431 . . . . 10.0 110.815 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.62 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 60.8 mt -109.99 119.38 58.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.685 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -74.34 117.22 15.9 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.801 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.9 OUTLIER -108.33 112.3 24.67 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.201 0.524 . . . . 10.0 111.813 -178.832 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.9 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.9 t70 -104.44 101.66 11.34 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.233 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.67 -167.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.871 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.409 ' O ' HD12 ' B' ' 57' ' ' LEU . 10.4 mmtt -123.48 161.7 24.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.47 -26.03 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.871 0.367 . . . . 10.0 111.63 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.82 -15.28 60.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.89 -0.596 . . . . 10.0 111.625 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 9.2 m -74.85 143.76 43.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.258 . . . . 10.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 19.2 p -94.94 165.9 12.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.822 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.433 HG13 HD12 ' B' ' 44' ' ' LEU . 53.9 t -63.99 -37.42 79.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.815 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -62.93 -35.1 78.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.451 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.439 ' O ' HG13 ' B' ' 30' ' ' ILE . 30.3 mt-10 -63.94 -36.11 82.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.419 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.944 HD11 HD21 ' B' ' 57' ' ' LEU . 63.6 mt -62.01 -44.6 96.37 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.04 -40.31 93.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.963 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -64.86 -37.15 86.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.272 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.439 HG13 ' O ' ' B' ' 26' ' ' GLU . 96.3 mt -64.13 -47.02 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.9 t -64.46 -33.74 64.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.248 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.756 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 6.8 tt0 -57.86 -40.02 79.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.629 179.206 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.53 -2.52 90.54 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.654 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.1 mt -106.8 -51.6 7.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.944 0.402 . . . . 10.0 111.281 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.58 -7.67 49.54 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.238 0.459 . . . . 10.0 112.238 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 62.39 29.48 17.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.932 0.396 . . . . 10.0 111.422 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.422 ' HA ' ' HD3' ' B' ' 37' ' ' ARG . 9.7 mmt180 -114.99 136.63 22.61 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.19 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.94 128.8 31.76 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.282 2.654 . . . . 10.0 112.684 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.756 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 51.5 Cg_endo -69.57 -14.46 36.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.384 2.723 . . . . 10.0 111.812 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.78 -43.72 85.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -99.12 14.54 28.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.921 -0.581 . . . . 10.0 112.096 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -87.07 127.2 35.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.211 -0.45 . . . . 10.0 109.929 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 31.8 mmt-85 -115.34 115.2 26.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.433 HD12 HG13 ' B' ' 24' ' ' VAL . 84.6 mt -97.29 115.09 27.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.224 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.16 111.6 22.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.06 0.457 . . . . 10.0 111.819 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -111.21 128.35 55.89 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.977 -1.12 . . . . 10.0 107.977 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 60.99 32.06 19.92 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.29 0.567 . . . . 10.0 109.776 -179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 68.34 17.45 9.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.148 -0.933 . . . . 10.0 111.791 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -125.31 149.99 47.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.071 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 28.8 tp -79.22 136.97 37.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.627 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 86.5 mt -86.26 174.86 8.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 10.0 111.736 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -110.57 125.48 53.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -62.26 -27.64 69.15 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -178.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.63 2.11 79.79 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.686 -0.768 . . . . 10.0 113.973 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -105.14 148.7 26.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.081 0.44 . . . . 10.0 111.282 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.7 p -83.85 166.85 17.58 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.882 179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.944 HD21 HD11 ' B' ' 27' ' ' LEU . 44.3 mt -57.94 -41.53 82.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.406 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.82 93.74 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.795 -0.717 . . . . 10.0 111.81 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.87 -24.59 65.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.768 0.318 . . . . 10.0 111.157 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 84.8 m -84.53 5.04 29.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.927 0.394 . . . . 10.0 111.854 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.76 14.67 60.82 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.679 -0.772 . . . . 10.0 114.149 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -87.17 79.43 8.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 117.134 0.467 . . . . 10.0 110.748 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 73.3 p -97.64 167.67 10.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.51 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 10.0 111.281 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -77.08 -35.37 56.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.739 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -90.05 -32.73 16.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.042 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.739 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -110.09 98.87 8.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.272 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -114.73 155.26 46.45 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.297 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.493 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 29.0 Cg_endo -64.48 -16.49 55.41 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.229 1.952 . . . . 10.0 111.342 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -106.2 -1.03 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.466 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.978 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -158.04 88.44 2.39 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.879 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.533 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.6 Cg_exo -78.3 140.18 17.2 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.821 2.348 . . . . 10.0 111.18 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.25 114.55 6.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 10.0 111.459 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.75 114.05 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.497 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.43 ' HB ' HD13 ' B' ' 7' ' ' ILE . 51.4 t -116.42 133.54 62.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.05 135.42 13.69 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.2 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.8 tp -114.38 107.06 15.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.792 0.33 . . . . 10.0 111.351 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.636 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -100.69 145.17 28.77 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -125.13 114.75 19.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -77.88 99.78 6.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.13 0.49 . . . . 10.0 111.44 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.408 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -117.74 128.54 54.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.21 131.91 51.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.822 0.304 . . . . 10.0 111.822 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 9.5 t70 73.27 -0.3 3.42 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.62 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 10.9 m -104.28 100.28 10.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.12 0.486 . . . . 10.0 110.518 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -67.78 -10.23 50.89 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.704 0.631 . . . . 10.0 112.704 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.426 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.7 tt0 -60.17 -22.84 63.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.942 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.02 -29.85 68.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.043 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 65.3 mt -83.73 -32.42 25.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.76 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.1 m -66.19 -37.08 84.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.741 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 2.4 mt -92.3 11.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.889 0.376 . . . . 10.0 111.585 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.5 101.49 17.63 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.821 0.343 . . . . 10.0 110.652 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 32.6 Cg_exo -63.84 -10.17 21.6 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.411 2.74 . . . . 10.0 112.8 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.01 -28.8 35.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.048 0.452 . . . . 10.0 110.999 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 11.8 m -113.84 -21.16 10.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.925 0.393 . . . . 10.0 111.596 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.463 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.8 m -126.57 149.25 67.47 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.376 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.89 162.42 41.98 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.634 2.223 . . . . 10.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.19 150.09 71.26 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.43 2.086 . . . . 10.0 111.652 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.55 84.41 3.93 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.291 0.567 . . . . 10.0 110.915 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.5 tp -108.49 122.46 40.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.115 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.8 Cg_exo -66.24 130.31 23.73 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.754 2.302 . . . . 10.0 111.06 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -35.71 81.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.025 0.441 . . . . 10.0 111.145 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.516 HG23 ' HG2' ' B' ' 103' ' ' MET . 30.6 m -73.07 -18.48 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.753 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.516 ' HG2' HG23 ' B' ' 102' ' ' VAL . 90.0 mmm -111.53 28.55 8.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.754 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.52 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 88.0 tttt -94.76 -51.04 0.25 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 112.807 0.669 . . . . 10.0 112.807 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 10.7 Cg_exo -72.9 56.54 3.01 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 122.593 2.195 . . . . 10.0 112.403 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' B' ' 115' ' ' GLN . 2.8 mt-30 -132.29 127.91 36.64 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -73.98 146.77 43.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.859 0.361 . . . . 10.0 111.913 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.7 m -63.82 139.05 58.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.745 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.21 -117.62 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.867 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.66 -37.94 6.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.997 0.427 . . . . 10.0 111.089 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.978 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 13.8 m -95.13 169.78 9.87 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.782 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.46 142.1 39.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 70.92 -5.49 1.48 Allowed 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.573 0.546 . . . . 10.0 111.361 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -84.64 112.08 20.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.263 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.462 ' HB3' ' HB2' ' B' ' 106' ' ' GLN . 43.8 mt-30 -106.72 143.66 34.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.255 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.18 114.29 26.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.6 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -71.91 132.25 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.057 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.086 0.469 . . . . 10.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.683 0.278 . . . . 10.0 111.083 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.566 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.0 ttpt -113.2 113.43 25.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.45 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.427 HD22 ' HE2' ' C' ' 44' ' ' PHE . 40.0 mt -90.46 121.46 32.45 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 42.1 mt -106.04 130.0 58.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.088 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -101.3 170.63 8.11 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.625 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -59.15 -24.6 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -81.65 -2.65 51.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.319 . . . . 10.0 111.454 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.66 12.64 74.59 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.812 -0.709 . . . . 10.0 111.561 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.48 124.45 28.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.494 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 16.6 mt-10 -99.86 121.83 41.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.018 -179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -113.51 112.55 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.777 0.323 . . . . 10.0 111.504 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.62 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 13.8 mm -89.54 119.25 36.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.2 t -104.55 134.99 44.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.9 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 69.2 tttt -62.69 128.94 38.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' C' ' 15' ' ' ARG . 29.8 ttt180 -52.27 -38.04 57.13 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.379 0.424 . . . . 10.0 112.098 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.412 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.0 tt0 -54.59 -44.17 72.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.924 0.392 . . . . 10.0 111.206 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -80.22 -35.06 36.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.169 0.509 . . . . 10.0 110.215 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.36 87.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.51 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 74.6 mt -58.71 -50.67 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.585 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.26 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.486 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.2 m -64.99 -34.65 78.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.167 0.508 . . . . 10.0 109.858 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.87 -2.05 90.0 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.824 -0.625 . . . . 10.0 112.291 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -88.59 -23.4 23.12 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 17.3 mt -80.76 152.78 4.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -72.26 80.86 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 10.0 110.769 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.33 165.98 14.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.42 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 85.5 mmm -78.85 40.4 0.39 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.26 -24.76 64.02 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.344 -0.614 . . . . 10.0 109.344 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.33 14.36 13.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.01 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.22 -61.73 6.99 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 115.835 -0.621 . . . . 10.0 113.138 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -71.49 -165.87 0.22 Allowed 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.679 2.253 . . . . 10.0 112.243 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.0 -51.57 10.17 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.589 -0.815 . . . . 10.0 112.219 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -144.15 142.53 30.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.82 0.343 . . . . 10.0 110.233 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -114.22 88.45 2.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.757 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.84 161.53 30.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.077 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.35 -31.0 69.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.331 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -64.11 -38.5 91.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.152 0.501 . . . . 10.0 110.254 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.429 ' O ' HG22 ' C' ' 42' ' ' VAL . 22.0 tp10 -73.4 -24.69 60.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.637 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -78.34 -11.63 59.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.051 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -86.46 -55.34 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.674 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.566 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 53.9 mt-10 -129.75 91.65 3.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.359 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.429 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.7 t -78.24 124.38 36.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.309 -0.405 . . . . 10.0 109.961 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -98.79 106.26 18.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 10.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.474 ' HB3' HD12 ' C' ' 47' ' ' ILE . 81.1 m-85 -88.05 91.35 8.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.159 0.504 . . . . 10.0 110.939 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 45' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 47.8 mtt180 -76.09 134.91 39.9 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.29 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 4.7 mm-40 77.47 4.6 3.1 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 124.018 0.824 . . . . 10.0 112.174 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.8 mt -109.18 115.97 55.9 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.549 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 23.8 Cg_exo -67.31 151.25 80.99 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 123.104 2.536 . . . . 10.0 111.926 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.1 p -63.0 -37.87 88.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.64 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -55.66 -55.27 34.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.901 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.6 -31.6 53.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.627 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 25.8 tp -65.54 -40.01 92.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.934 0.397 . . . . 10.0 110.102 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -62.32 -34.93 77.58 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.113 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -64.95 -39.81 94.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.894 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.73 -49.22 76.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.361 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 63.3 m -57.01 -41.39 78.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.158 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -64.51 -41.11 96.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.128 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.57 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 78.1 t80 -65.48 -41.83 92.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.652 179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.462 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.9 m-85 -63.57 -45.04 92.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 46.4 m -59.33 -43.97 92.67 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.451 0.643 . . . . 10.0 109.68 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.493 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 36.9 t80 -63.76 -44.59 93.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.135 179.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -61.39 -40.39 94.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.938 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.462 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.6 t -57.16 -52.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.858 0.361 . . . . 10.0 110.589 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -70.81 -38.24 73.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.248 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.71 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 76.8 t80 -56.73 -50.24 72.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.045 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.84 -13.33 59.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.87 0.367 . . . . 10.0 111.84 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 67' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 37.3 t30 -88.64 -44.82 10.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -154.39 -31.0 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.873 0.694 . . . . 10.0 112.873 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.71 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.7 m -74.8 29.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 -179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.1 -1.22 39.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.216 0.531 . . . . 10.0 110.399 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -76.5 -24.52 53.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.396 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.488 HG12 ' O ' ' C' ' 69' ' ' SER . 31.7 pt -96.13 166.17 14.87 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.428 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.86 175.74 8.58 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.928 2.419 . . . . 10.0 112.661 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -72.59 171.72 11.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.476 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -50.77 128.6 27.18 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.675 0.274 . . . . 10.0 111.043 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -53.89 128.01 27.91 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.185 2.59 . . . . 10.0 112.979 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.58 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.1 pt -85.48 41.72 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.149 0.499 . . . . 10.0 111.113 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -90.96 -55.89 0.26 Allowed Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.96 -0.563 . . . . 10.0 112.456 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 8.4 Cg_exo -72.14 128.58 14.05 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.888 1.725 . . . . 10.0 111.011 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -75.2 0.46 16.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.0 mm -85.85 99.35 7.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.272 0.558 . . . . 10.0 111.35 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -168.02 -42.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.049 -0.978 . . . . 10.0 109.457 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.416 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 29.1 tp -65.84 -26.86 67.85 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.622 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 29.6 mp0 -62.91 -31.84 72.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.9 -1.045 . . . . 10.0 109.884 178.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.705 ' HB3' HD21 ' A' ' 8' ' ' LEU . 66.4 mt -79.72 -35.12 39.41 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -23.99 67.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.403 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 49.5 ttp -58.99 -28.95 66.85 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.269 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 88' ' ' ALA . . . . . 0.51 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -58.03 -43.07 86.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.608 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.16 -52.42 0.59 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.164 1.172 . . . . 10.0 114.164 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -79.61 25.15 0.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.294 0.479 . . . . 10.0 112.294 -178.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.51 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 58.7 m-85 . . . . . 0 C--O 1.244 0.791 0 CA-C-O 118.699 -0.667 . . . . 10.0 109.625 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.539 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.453 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.44 -62.89 1.53 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.265 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' C' ' 85' ' ' LEU . 37.3 tp -61.01 -34.01 74.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.982 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.427 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 60.3 tt0 -58.53 -30.23 66.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.133 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -98.63 -38.32 9.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.02 0.438 . . . . 10.0 110.473 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.507 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 77.5 mt -63.4 -35.7 81.29 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.94 -0.573 . . . . 10.0 112.233 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.38 92.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 10.0 110.329 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.99 -22.83 62.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.125 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.17 -9.54 59.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.309 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.467 ' HB2' ' CE1' ' C' ' 58' ' ' TYR . . . -105.14 -51.16 3.08 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.407 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' C' ' 77' ' ' ILE . 0.2 OUTLIER -137.2 129.11 29.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.736 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.407 ' H ' HD12 ' A' ' 17' ' ' ILE . 2.5 mp -91.28 97.65 7.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 52.4 tttt -111.53 103.68 55.32 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.951 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -97.05 45.17 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.429 2.753 . . . . 10.0 111.611 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.555 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 28.9 mttt -93.28 -178.08 4.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.413 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -82.33 147.86 28.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.21 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.444 HD11 ' HG ' ' C' ' 83' ' ' LEU . 30.7 mm -110.33 106.45 20.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.15 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.006 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -121.87 135.49 25.32 Favored Pre-proline 0 C--N 1.32 -0.695 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.538 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.4 Cg_exo -34.25 135.12 0.13 Allowed 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 124.176 3.251 . . . . 10.0 113.6 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.723 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 13.4 Cg_endo -56.64 141.09 91.49 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 123.293 2.662 . . . . 10.0 112.511 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.434 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -78.81 118.42 72.31 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.763 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 19.9 Cg_endo -59.98 -21.27 64.22 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.391 2.727 . . . . 10.0 113.165 -179.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -63.97 -34.55 78.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.818 0.342 . . . . 10.0 111.095 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.668 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.3 t -122.68 -112.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -175.21 61.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.185 0.517 . . . . 10.0 111.095 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.3 tttm -159.85 151.87 20.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.447 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.723 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -70.76 156.64 39.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.818 0.342 . . . . 10.0 110.744 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -103.01 170.81 7.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.107 -179.27 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -119.88 111.89 18.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.844 0.354 . . . . 10.0 110.741 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.006 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -151.57 -72.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.183 -179.902 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.41 -62.63 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.309 -0.853 . . . . 10.0 109.511 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.877 0.37 . . . . 10.0 111.022 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -166.69 121.72 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.671 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.27 117.14 48.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.996 0.427 . . . . 10.0 110.856 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.42 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 68.8 m-85 -104.25 115.47 30.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.653 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.746 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -130.71 156.33 45.12 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.892 0.377 . . . . 10.0 111.37 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.555 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 55.2 mtm -125.61 111.81 15.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.874 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.548 HD13 ' HB ' ' B' ' 75' ' ' VAL . 42.8 mm -82.19 104.32 10.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -100.27 97.39 8.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.547 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.0 ttp85 -89.19 75.71 7.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.7 -1.222 . . . . 10.0 107.7 177.696 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 22.3 t-80 67.13 -87.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.448 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.46 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 65.4 mttt -113.67 11.09 18.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 10.0 111.001 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 5.8 m -116.61 96.92 5.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.383 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 24.6 m -96.13 121.14 37.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.897 0.38 . . . . 10.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.567 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.1 mt -112.21 119.19 59.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.358 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.16 122.84 26.18 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.746 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -116.6 118.39 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.036 0.446 . . . . 10.0 112.003 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -103.4 101.58 11.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.96 -169.4 2.03 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.275 0.36 . . . . 10.0 110.784 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -127.54 163.82 23.33 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.6 -25.83 64.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -18.94 60.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.839 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' SER . . . . . 0.406 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 10.8 m -71.68 141.26 49.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.615 -0.266 . . . . 10.0 110.729 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.3 p -91.78 163.96 13.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.625 -0.261 . . . . 10.0 110.63 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.432 HG21 ' HB3' ' B' ' 51' ' ' LEU . 65.2 t -63.78 -36.32 76.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.925 0.393 . . . . 10.0 110.577 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -61.29 -36.13 79.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.645 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -63.33 -34.26 77.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.171 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.67 HD11 HD21 ' B' ' 57' ' ' LEU . 75.1 mt -61.58 -42.58 99.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.0 -32.03 73.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.283 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' B' ' 29' ' ' ARG . 19.0 mtp180 -66.08 -39.5 90.09 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 70.1 mt -67.33 -43.46 87.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.6 t -61.57 -38.09 79.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.432 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 38.4 tt0 -62.41 -30.12 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.537 . . . . 10.0 110.271 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.73 -0.14 86.2 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.869 -0.682 . . . . 10.0 112.362 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.9 mt -115.64 -55.29 4.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 10.0 111.079 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 66.4 mt -88.42 -11.5 45.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.453 -0.339 . . . . 10.0 111.138 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 46.4 mttt 55.7 52.84 10.31 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.918 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.63 146.57 62.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.689 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -54.49 121.76 10.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.963 2.442 . . . . 10.0 112.268 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.74 -16.65 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.783 2.322 . . . . 10.0 111.928 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -26.75 65.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.387 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -101.22 9.62 41.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.229 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -95.03 131.12 41.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.453 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 56.8 mmt-85 -117.9 114.26 22.96 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 82.1 mt -94.15 117.77 30.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.779 0.324 . . . . 10.0 110.56 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -111.44 124.5 52.39 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 112.268 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 38.9 tttm -127.22 128.34 45.9 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 61.59 31.66 18.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.899 0.381 . . . . 10.0 110.642 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 70.91 13.44 7.04 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.378 -0.828 . . . . 10.0 111.89 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -124.25 144.89 49.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.804 0.335 . . . . 10.0 111.039 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 42.4 tp -73.26 127.69 33.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.502 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.432 ' HB3' HG21 ' B' ' 24' ' ' VAL . 97.1 mt -70.46 155.76 40.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.027 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 20.3 t0 -87.27 118.21 26.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.647 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.81 -28.1 68.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.825 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.91 24.39 32.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.454 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 23.8 mttp -127.78 160.16 32.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.963 0.411 . . . . 10.0 111.02 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 35.0 p -89.12 166.59 13.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.215 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.67 HD21 HD11 ' B' ' 27' ' ' LEU . 44.0 mt -59.35 -40.53 86.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.01 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.07 -39.9 96.38 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.875 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -72.83 -17.39 61.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.962 0.41 . . . . 10.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 60.2 m -94.91 5.96 50.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.728 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.52 16.89 63.17 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.71 -0.757 . . . . 10.0 113.355 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 36.9 m-85 -84.64 63.62 8.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.151 0.5 . . . . 10.0 110.451 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 3.5 p -84.85 149.83 25.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.12 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 2.3 m -62.49 -21.58 65.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.992 0.425 . . . . 10.0 110.673 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -63.76 -30.26 71.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.208 -0.451 . . . . 10.0 109.904 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.16 5.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.751 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.42 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -90.58 87.84 6.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.164 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -100.11 159.55 29.51 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.112 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.86 -16.76 55.84 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.638 2.225 . . . . 10.0 111.897 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.412 HE21 ' HB2' ' B' ' 70' ' ' GLN . 0.0 OUTLIER -113.67 5.95 16.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.442 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.606 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -156.26 79.05 4.08 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.339 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.555 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.6 Cg_exo -74.29 141.78 29.37 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.612 2.208 . . . . 10.0 111.545 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.09 123.53 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.069 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 123.6 24.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.571 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.548 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.0 t -123.77 129.19 74.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.55 133.43 11.8 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.697 -0.763 . . . . 10.0 111.896 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.4 tp -110.29 99.1 8.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.009 0.433 . . . . 10.0 111.116 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.453 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -95.65 114.3 26.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.013 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -97.84 118.77 35.15 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -83.46 100.86 11.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.146 0.498 . . . . 10.0 111.244 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -120.36 141.11 50.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.695 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.61 137.51 54.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 4.7 t70 70.79 11.81 7.16 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.409 0.623 . . . . 10.0 110.854 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 9.4 m -111.68 98.85 7.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.214 0.531 . . . . 10.0 111.063 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -72.78 -17.92 61.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.576 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 30.0 tt0 -56.98 -26.05 59.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.641 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.67 -16.8 61.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.71 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 58.7 mt -93.4 -15.57 25.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.949 0.404 . . . . 10.0 111.345 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 24.0 m -91.93 -30.26 16.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.115 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.2 mt -85.45 -3.3 8.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.29 0.567 . . . . 10.0 110.597 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -100.38 110.29 59.59 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.152 -0.477 . . . . 10.0 111.079 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 59.7 Cg_endo -72.72 -1.67 10.71 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.027 2.485 . . . . 10.0 111.736 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -84.57 -24.37 29.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.195 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -112.79 -39.4 4.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.599 -0.728 . . . . 10.0 111.064 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 25.5 m -117.34 155.62 49.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.978 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.16 154.98 42.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.558 2.172 . . . . 10.0 111.912 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.44 135.22 68.15 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.855 2.37 . . . . 10.0 112.014 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -76.69 106.08 8.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.316 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 27.4 tp -141.64 121.29 8.2 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.687 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 26.0 Cg_exo -64.81 133.15 35.13 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.535 2.157 . . . . 10.0 111.687 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -60.72 -27.67 68.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.53 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.668 ' HB ' HG13 ' A' ' 29' ' ' VAL . 18.1 m -65.02 -25.14 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.279 0.561 . . . . 10.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.493 ' HG2' HG23 ' B' ' 102' ' ' VAL . 83.4 mmm -121.47 54.88 1.1 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.281 -1.007 . . . . 10.0 108.281 179.308 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.648 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 69.7 tttt -126.87 -54.96 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.465 -0.789 . . . . 10.0 112.445 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 3.5 Cg_exo -82.23 70.11 7.18 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.633 2.222 . . . . 10.0 111.645 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -128.64 -167.41 1.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.796 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.784 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.6 t70 -93.41 179.78 5.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 8.6 m -110.7 136.57 49.58 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.66 0.267 . . . . 10.0 110.402 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -86.35 -147.71 11.07 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.511 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 3.6 m -111.66 -22.47 11.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.334 0.588 . . . . 10.0 110.348 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.625 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.0 OUTLIER -86.63 159.79 19.1 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.604 -0.725 . . . . 10.0 109.918 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 112' ' ' ALA . . . . . 0.606 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.4 121.95 15.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 t30 69.94 17.28 7.51 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.782 0.677 . . . . 10.0 111.572 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.625 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 65.4 tt0 -81.78 129.54 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.995 0.426 . . . . 10.0 110.249 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -110.13 143.04 40.79 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.097 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -114.09 105.76 13.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.353 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.418 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 1.9 t -72.38 137.65 23.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.911 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.447 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 22.5 mp0 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.494 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.89 0.376 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -104.16 108.36 19.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.174 -0.467 . . . . 10.0 111.181 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.704 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 47.8 mt -81.8 126.66 32.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.527 HD11 ' HB3' ' C' ' 41' ' ' GLU . 40.9 mt -108.13 114.14 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.813 0.34 . . . . 10.0 110.582 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.66 165.66 16.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.674 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m -61.65 -25.68 67.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.908 0.385 . . . . 10.0 111.655 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -79.02 0.15 28.86 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.647 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.71 26.22 59.15 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 9' ' ' HIS . . . . . 0.46 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 1.8 t60 -91.08 138.79 31.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.44 . . . . 10.0 110.381 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.58 132.53 49.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.316 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.704 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 59.9 m-85 -125.12 106.85 10.22 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.257 -0.428 . . . . 10.0 109.983 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.567 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 27.4 mm -88.68 110.81 21.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.148 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 43.1 t -98.51 125.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.04 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -59.74 128.25 35.99 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.298 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.46 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 33.0 ttt-85 -53.28 -31.26 42.94 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.33 -0.395 . . . . 10.0 111.639 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -52.34 -44.8 65.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.078 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -87.09 -30.03 21.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.514 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 18' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -62.42 -32.44 73.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.025 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.1 -46.87 87.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.739 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.439 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.6 m -72.61 -36.21 68.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.408 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 27.5 m -65.26 -24.07 67.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.146 0.498 . . . . 10.0 110.301 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.71 -8.33 82.96 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.694 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -87.74 -19.57 27.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.454 0.645 . . . . 10.0 109.584 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -79.21 148.35 6.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.313 -0.858 . . . . 10.0 109.312 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.7 79.8 0.84 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 10.0 110.697 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -90.01 172.87 8.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.313 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.539 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.8 mmm -82.87 38.59 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.11 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mp -66.8 -32.57 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.288 0.566 . . . . 10.0 109.811 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -90.17 14.54 12.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.957 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.56 -62.5 3.83 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.657 -0.701 . . . . 10.0 112.89 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.99 -167.5 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.726 2.284 . . . . 10.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.63 -90.01 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.962 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -116.08 132.33 56.69 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.706 -0.291 . . . . 10.0 110.534 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.76 92.95 8.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.306 -0.406 . . . . 10.0 109.987 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.73 176.51 8.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.187 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.37 -25.74 68.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.268 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.86 -48.07 78.18 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.458 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.2 mp0 -70.46 -24.45 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.246 -0.888 . . . . 10.0 111.324 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 5.1 m -78.29 -47.05 18.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.017 0.437 . . . . 10.0 110.621 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -70.83 -44.16 67.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.878 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.527 ' HB3' HD11 ' C' ' 4' ' ' ILE . 49.5 mt-10 -128.62 103.27 7.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.436 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.458 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -90.01 104.69 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 43' ' ' ASN . . . . . 0.431 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 14.6 t-20 -84.22 128.5 34.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.669 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.538 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 81.4 m-85 -109.15 124.43 50.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.345 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -96.41 128.1 43.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.334 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 67.48 19.76 9.93 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 10.0 112.79 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' C' ' 44' ' ' PHE . 67.2 mt -113.45 111.4 49.54 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.212 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.7 143.57 46.68 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 123.038 2.492 . . . . 10.0 111.645 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -34.9 70.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.904 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.11 -55.54 31.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 10.0 111.742 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.6 m -71.33 -30.42 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.99 -0.284 . . . . 10.0 111.002 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 43.9 tp -64.34 -35.9 82.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.447 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -59.59 -39.76 85.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.589 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -65.73 -36.18 82.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.315 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 36.3 t -68.53 -44.28 83.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.64 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.28 -42.3 98.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.614 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 72.1 mtm -66.4 -35.21 79.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.467 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.507 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 75.7 t80 -65.21 -42.65 93.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.174 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.47 ' O ' HG23 ' C' ' 63' ' ' VAL . 9.5 m-85 -62.39 -47.44 84.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.703 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.0 m -57.53 -42.46 82.92 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.944 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -64.48 -45.57 86.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.364 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptt -63.79 -34.83 78.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 112.006 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.47 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -62.01 -40.76 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.102 0.477 . . . . 10.0 110.52 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -84.52 -34.45 23.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.737 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.701 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 45.9 t80 -57.71 -57.33 13.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.027 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.97 54.47 3.1 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 67' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 0.8 OUTLIER -162.16 -58.87 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.322 -179.049 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.58 -33.82 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.634 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.701 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 7.2 m -87.12 35.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.082 0.468 . . . . 10.0 111.949 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -9.76 59.09 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.012 0.434 . . . . 10.0 110.535 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -92.95 -9.54 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.658 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 34.1 pt -100.17 164.36 16.53 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.155 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.61 164.23 27.2 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.625 2.217 . . . . 10.0 112.948 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.8 tp10 -72.63 170.63 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.315 178.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.477 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 29.9 t80 -48.15 128.24 12.3 Favored Pre-proline 0 C--O 1.233 0.197 0 O-C-N 123.295 0.372 . . . . 10.0 110.824 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.96 121.77 5.45 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.545 2.83 . . . . 10.0 113.395 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.576 ' HA ' ' HG ' ' A' ' 16' ' ' LEU . 2.7 pt -80.15 45.81 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.576 -0.738 . . . . 10.0 111.855 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.638 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.21 -57.5 0.1 Allowed Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 112.724 0.639 . . . . 10.0 112.724 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.638 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 2.6 Cg_exo -76.37 97.01 1.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.202 1.935 . . . . 10.0 111.59 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.77 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -74.28 59.81 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.684 0.624 . . . . 10.0 112.684 -179.525 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.1 mm -116.25 13.73 7.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.879 0.847 . . . . 10.0 108.942 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.56 -38.43 54.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.328 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 15.4 tp -66.58 -30.07 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.137 0.494 . . . . 10.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.542 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 17.5 mp0 -61.42 -35.77 78.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.397 -0.82 . . . . 10.0 109.827 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 8' ' ' LEU . 46.5 mt -80.73 -33.55 35.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.335 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 3.3 tt -63.13 -27.15 69.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.685 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.2 ttp -59.5 -20.73 57.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.767 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -42.06 88.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.606 0.241 . . . . 10.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.59 -50.94 0.51 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -79.98 12.15 2.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.883 0.373 . . . . 10.0 111.586 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.53 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 72.6 m-85 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.329 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.425 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.316 -0.314 . . . . 10.0 112.316 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -67.93 0.28 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.164 0.801 . . . . 10.0 113.164 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' C' ' 85' ' ' LEU . 41.8 tp -63.95 -32.31 73.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.585 -0.279 . . . . 10.0 111.514 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.408 ' HG3' ' HG ' ' C' ' 86' ' ' LEU . 63.0 tt0 -57.6 -42.77 83.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.041 0.448 . . . . 10.0 110.25 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -78.88 -40.28 32.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.994 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.447 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 83.4 mt -61.02 -32.77 72.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.62 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.86 -43.52 92.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.791 0.329 . . . . 10.0 110.544 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 tp -70.27 -22.73 62.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.44 0.638 . . . . 10.0 109.956 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.77 2.23 56.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.368 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -114.07 -39.41 3.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.157 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.7 OUTLIER -156.68 118.91 3.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.016 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.1 mt -86.48 85.57 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 13.9 ttpt -96.21 111.89 57.98 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.159 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -95.46 36.04 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.315 2.677 . . . . 10.0 111.352 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -82.29 -177.95 6.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.341 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.836 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 28.4 mm-40 -87.35 166.03 15.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.547 0.573 . . . . 10.0 112.547 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.0 mm -116.41 143.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.691 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.122 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 0.1 OUTLIER -168.83 143.03 2.52 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.035 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 1.122 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 65.8 Cg_exo -43.74 140.28 4.72 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.258 2.639 . . . . 10.0 112.526 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.817 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.2 Cg_endo -63.84 139.28 67.64 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.859 2.373 . . . . 10.0 111.826 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -76.44 125.72 87.19 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.66 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.59 -11.03 30.09 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.097 2.531 . . . . 10.0 112.936 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -42.38 76.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.135 0.493 . . . . 10.0 110.478 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -119.5 -125.51 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -159.41 55.56 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.38 0.61 . . . . 10.0 110.727 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 17.9 tttm -153.06 154.11 34.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.408 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.817 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -76.52 156.38 32.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.716 0.293 . . . . 10.0 110.935 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -95.53 169.91 9.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.601 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.836 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 25.1 tt0 -122.32 119.41 31.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.03 0.443 . . . . 10.0 110.967 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.086 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -153.17 -68.25 0.15 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.991 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.0 -56.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.806 -0.616 . . . . 10.0 109.875 179.908 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tmm? . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 121.02 0.438 . . . . 10.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -79.23 137.17 37.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.003 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.572 HG11 HD13 ' B' ' 57' ' ' LEU . 98.3 t -123.6 119.49 57.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.29 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.555 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.6 m-85 -109.3 115.03 29.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.994 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.792 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.8 OUTLIER -131.13 159.75 36.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.811 0.339 . . . . 10.0 111.39 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 35.0 mtm -127.52 106.17 8.99 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.862 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -78.36 105.39 7.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -107.62 104.15 13.62 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 -178.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.45 ' HB2' HD23 ' B' ' 77' ' ' LEU . 16.5 ttp85 -92.54 76.39 5.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.339 -1.356 . . . . 10.0 107.339 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.722 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.4 t-80 67.6 -81.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.428 -0.805 . . . . 10.0 111.083 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 mttt -113.87 -12.65 12.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.94 0.4 . . . . 10.0 111.743 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.5 105.14 17.37 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.6 m -106.68 120.48 42.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.63 0.253 . . . . 10.0 111.24 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.48 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 58.3 mt -113.44 118.09 57.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.81 -179.735 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -77.26 118.42 19.73 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.792 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -110.02 116.74 32.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.448 0.642 . . . . 10.0 112.003 -178.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.836 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -101.59 97.99 8.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.706 -1.22 . . . . 10.0 107.706 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.44 -169.69 1.9 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.222 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -127.43 158.49 37.2 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.73 -20.7 61.81 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.467 0.543 . . . . 10.0 112.467 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.19 -15.29 58.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.835 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 20.1 m -81.09 143.27 32.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.742 0.306 . . . . 10.0 111.367 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 40.0 p -90.55 168.28 11.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.455 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 57.2 t -64.63 -34.32 69.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.638 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -62.2 -35.94 80.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.412 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -63.5 -29.8 71.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.105 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.927 HD11 HD21 ' B' ' 57' ' ' LEU . 81.1 mt -67.21 -47.31 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -61.36 -33.34 73.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.877 -0.602 . . . . 10.0 110.573 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.55 -34.31 77.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.138 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.1 mt -70.57 -46.85 68.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.67 -36.41 73.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.327 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -57.58 -40.25 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.69 -14.66 79.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.85 -0.691 . . . . 10.0 113.241 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 88.0 mt -95.42 -51.94 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 122.663 -0.316 . . . . 10.0 111.399 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 46.1 mt -85.54 -11.63 53.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.452 0.538 . . . . 10.0 112.452 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.7 mttm 60.92 41.24 14.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' B' ' 37' ' ' ARG . 47.5 mtt-85 -131.82 151.55 78.76 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.85 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.42 131.51 46.67 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.308 2.672 . . . . 10.0 112.589 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.46 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 72.6 Cg_endo -77.95 -20.9 11.33 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.877 2.384 . . . . 10.0 111.971 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -70.68 -23.74 62.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -98.87 11.41 38.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.349 0.595 . . . . 10.0 111.194 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' GLN . . . . . 0.46 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 77.1 mt-30 -99.42 133.33 43.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.469 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.554 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 47.5 mmt-85 -115.0 118.22 32.8 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.492 ' HB3' HD12 ' B' ' 51' ' ' LEU . 41.1 mt -96.93 114.18 25.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.844 0.354 . . . . 10.0 111.144 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -112.33 127.23 55.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.137 0.494 . . . . 10.0 111.569 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -137.22 128.82 28.57 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.31 39.05 15.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.91 0.386 . . . . 10.0 111.214 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 64.27 17.06 10.51 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.353 -0.839 . . . . 10.0 111.808 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -128.72 155.19 45.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.858 0.361 . . . . 10.0 111.286 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.94 133.71 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.492 HD12 ' HB3' ' B' ' 44' ' ' LEU . 94.9 mt -76.77 155.95 32.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.835 0.35 . . . . 10.0 111.511 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -100.95 114.1 27.69 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.366 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.65 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 2.3 m-20 -64.86 -15.7 62.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.725 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.88 14.54 64.55 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.885 -0.674 . . . . 10.0 112.751 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -130.72 160.9 32.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.753 0.311 . . . . 10.0 110.693 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 43.4 p -86.6 165.56 16.09 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.927 HD21 HD11 ' B' ' 27' ' ' LEU . 84.7 mt -57.63 -39.68 77.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.398 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.06 85.33 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.998 -0.62 . . . . 10.0 112.382 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -81.15 -12.98 59.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.905 0.383 . . . . 10.0 111.507 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' CYS . . . . . 0.441 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 57.8 m -96.83 2.27 51.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 10.0 111.105 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.41 9.09 62.04 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.736 -0.745 . . . . 10.0 113.32 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.523 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 69.8 m-85 -86.28 62.6 7.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.233 0.539 . . . . 10.0 110.39 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.7 p -88.21 154.2 20.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.544 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.9 m -61.76 -15.36 40.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.053 0.454 . . . . 10.0 111.313 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -72.18 -38.21 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.263 0.554 . . . . 10.0 109.966 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.08 -46.11 7.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.554 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.555 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -87.76 92.85 9.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -99.4 154.11 37.45 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.17 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.96 -13.62 38.45 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.87 2.38 . . . . 10.0 112.078 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 11.0 pt20 -110.39 0.69 18.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.217 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.493 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -157.9 89.27 2.37 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.586 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.548 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.9 Cg_exo -74.03 141.78 30.22 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.742 2.295 . . . . 10.0 111.568 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.13 116.44 12.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.891 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.34 128.2 35.51 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.555 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 24.3 t -125.42 131.34 72.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.99 122.82 6.42 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.669 -0.777 . . . . 10.0 111.877 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' B' ' 9' ' ' ARG . 42.6 tp -101.53 106.16 17.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 10.0 111.128 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.554 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -101.07 105.51 16.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.458 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.04 117.65 30.04 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -81.7 106.19 13.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.008 0.432 . . . . 10.0 111.573 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.78 128.18 54.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.3 143.2 57.21 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.917 -0.313 . . . . 10.0 111.276 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.29 -3.39 1.85 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.515 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.46 96.17 5.29 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.539 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -77.72 12.65 1.59 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.955 -178.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -62.84 -26.83 68.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.65 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.08 78.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.972 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -70.0 -33.16 71.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.795 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.7 m -74.71 -30.78 61.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.774 -0.648 . . . . 10.0 111.21 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.722 HG12 ' HB2' ' B' ' 10' ' ' HIS . 59.0 mt -84.33 -35.29 10.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.252 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 28.6 tt0 -61.04 115.36 13.79 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.633 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.604 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.9 Cg_exo -65.93 -14.96 46.97 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.294 2.663 . . . . 10.0 112.51 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.59 -37.65 62.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.026 0.441 . . . . 10.0 110.147 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.37 -35.91 12.16 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.657 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.604 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 1.4 m -128.53 144.62 52.78 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.508 -0.314 . . . . 10.0 111.192 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.33 145.82 60.88 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.377 2.052 . . . . 10.0 111.083 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.66 128.61 28.92 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.896 2.397 . . . . 10.0 111.624 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -63.01 111.01 1.99 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.918 -0.583 . . . . 10.0 112.174 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 26.4 tp -131.08 131.56 23.25 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.048 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 31.3 Cg_exo -62.52 128.65 24.14 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 122.686 2.257 . . . . 10.0 111.733 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -65.41 -37.65 87.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.439 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' B' ' 103' ' ' MET . 28.1 m -67.22 -20.86 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.318 0.58 . . . . 10.0 110.694 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.506 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.3 mmm -114.65 52.98 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.027 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.714 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 33.1 tttm -126.27 -54.22 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 112.778 0.658 . . . . 10.0 112.778 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.714 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 72.8 Cg_endo -74.84 63.35 5.84 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.098 1.865 . . . . 10.0 111.858 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -128.92 -173.93 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.813 -0.631 . . . . 10.0 109.609 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.92 178.58 5.24 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.706 -0.397 . . . . 10.0 111.096 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -96.44 139.61 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.723 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 109' ' ' GLY . . . . . 0.424 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -89.13 -156.71 32.01 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.26 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.84 -34.23 16.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.092 0.472 . . . . 10.0 110.553 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.54 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.9 m -84.48 162.82 19.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.067 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 112' ' ' ALA . . . . . 0.493 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -70.18 129.08 38.41 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.17 4.45 4.9 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.757 0.661 . . . . 10.0 111.511 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.54 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 35.2 tt0 -75.4 141.06 43.3 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -118.19 147.19 43.61 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.091 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -120.32 109.86 15.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.225 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.482 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -77.23 137.41 22.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.122 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.859 179.273 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.235 0.304 0 CA-C-O 120.932 0.396 . . . . 10.0 110.732 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.497 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.9 ttpt -102.42 111.15 23.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.956 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 66.3 mt -92.2 111.37 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -97.37 122.43 48.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.975 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 10.3 p -95.34 171.47 8.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.804 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.8 m -70.19 -7.59 43.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.839 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -91.64 -3.63 56.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.01 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.39 5.66 84.78 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.16 -0.776 . . . . 10.0 111.16 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.11 121.2 26.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -102.52 120.47 40.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.274 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -106.9 123.57 48.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.211 -0.45 . . . . 10.0 111.547 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.4 mm -100.7 117.69 46.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.844 -0.798 . . . . 10.0 108.844 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.15 139.68 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.603 -0.147 . . . . 10.0 110.603 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.836 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 56.2 tttt -56.44 130.41 44.72 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.405 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 33.7 ttt180 -53.99 -37.99 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.759 0.281 . . . . 10.0 111.759 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.519 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 35.2 tt0 -55.84 -53.21 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 10.0 110.842 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -66.77 -36.57 82.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.717 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.14 86.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.827 179.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 69.5 mt -61.27 -52.02 66.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.701 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.401 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.8 m -60.81 -41.43 95.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -64.74 -39.28 93.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.715 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.76 -10.88 80.64 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.121 -0.561 . . . . 10.0 112.662 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -82.69 -15.26 52.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.508 0.671 . . . . 10.0 109.743 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.1 mt -88.34 159.63 2.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -67.33 86.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.105 0.479 . . . . 10.0 111.435 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.92 165.91 11.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.969 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.425 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 96.3 mmm -76.8 41.89 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.92 -28.68 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.263 0.554 . . . . 10.0 109.835 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.89 15.49 22.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.236 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.45 -64.54 3.92 Favored Glycine 0 CA--C 1.52 0.391 0 CA-C-N 115.758 -0.655 . . . . 10.0 113.039 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.72 -154.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.612 2.208 . . . . 10.0 111.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.57 -94.95 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.743 -0.741 . . . . 10.0 112.089 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -113.41 112.01 22.92 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.827 0.346 . . . . 10.0 110.728 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -81.6 100.71 9.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.528 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.07 156.56 39.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.619 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.78 -37.29 73.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.073 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -62.96 -36.53 83.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -71.7 -31.5 66.82 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.206 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -73.75 -32.93 64.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.979 0.419 . . . . 10.0 110.306 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -75.59 -37.73 59.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.497 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 36.5 mt-10 -132.55 88.31 2.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.731 179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.5 117.71 26.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.374 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -95.73 110.87 22.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.244 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.515 ' HB3' HD12 ' C' ' 47' ' ' ILE . 93.7 m-85 -94.66 115.58 27.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.895 0.379 . . . . 10.0 111.354 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -99.07 136.83 38.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.395 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 70.15 27.48 4.22 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.893 0.746 . . . . 10.0 111.703 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.515 HD12 ' HB3' ' C' ' 44' ' ' PHE . 78.4 mt -132.89 109.92 13.05 Favored Pre-proline 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.307 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.511 ' HG2' HG22 ' C' ' 51' ' ' VAL . 30.1 Cg_endo -64.89 152.22 83.01 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.912 2.408 . . . . 10.0 112.575 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.3 p -63.99 -34.44 78.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.946 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 50' ' ' HIS . . . . . 0.504 ' HE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -54.17 -57.7 10.15 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.511 HG22 ' HG2' ' C' ' 48' ' ' PRO . 35.8 m -64.77 -35.24 74.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.427 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.5 tp -63.98 -37.51 87.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.61 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 35.5 m -59.71 -40.67 88.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.584 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -68.49 -35.94 78.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.337 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.51 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -62.97 -47.98 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.27 -40.95 92.19 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.553 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.6 mtm -65.55 -41.31 93.13 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 56.0 t80 -65.43 -40.83 93.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.603 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.419 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.8 m-85 -62.66 -46.65 87.23 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 35.6 m -58.4 -44.62 89.05 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.329 0.585 . . . . 10.0 110.146 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.457 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 34.4 t80 -64.85 -41.84 95.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.36 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -63.26 -38.71 92.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.247 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.419 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.4 t -60.75 -47.54 92.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.8 mmt85 -71.65 -40.81 69.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.361 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.518 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 60.5 t80 -58.64 -47.58 83.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.981 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.59 32.39 0.79 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.968 0.413 . . . . 10.0 110.952 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -138.83 -56.01 0.61 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.649 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.04 -35.83 0.62 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.713 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.518 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.4 m -80.67 38.76 0.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.951 0.405 . . . . 10.0 111.892 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.01 -17.03 32.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.45 0.643 . . . . 10.0 109.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -78.46 -14.78 59.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.489 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.756 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.46 166.85 12.15 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.377 -0.601 . . . . 10.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.756 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 44.7 Cg_endo -67.79 166.61 23.77 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.201 1.934 . . . . 10.0 113.247 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.565 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 7.9 tp10 -74.37 171.75 13.13 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.417 -0.957 . . . . 10.0 108.417 178.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.565 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 18.2 t80 -52.3 128.49 40.8 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 110.394 -0.224 . . . . 10.0 110.394 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 76' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 44.5 Cg_exo -57.01 129.55 35.09 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.811 2.34 . . . . 10.0 112.249 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.537 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.1 pt -84.05 40.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.307 0.575 . . . . 10.0 111.437 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.69 -57.3 0.36 Allowed Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.736 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -70.17 117.0 4.86 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.789 1.66 . . . . 10.0 110.778 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.519 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 3.3 pt-20 -73.98 3.73 6.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 43.0 mm -83.07 82.11 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.398 0.618 . . . . 10.0 110.026 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.65 -37.36 0.12 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.428 -0.805 . . . . 10.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.513 ' HB3' ' HE2' ' A' ' 18' ' ' LYS . 20.1 tp -66.2 -25.42 66.92 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 22.4 mp0 -63.39 -32.93 74.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.715 -1.129 . . . . 10.0 109.508 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 8' ' ' LEU . 80.5 mt -78.42 -34.2 48.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.759 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 9' ' ' GLN . 6.2 tt -66.2 -27.86 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.067 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 46.8 ttp -59.21 -25.9 64.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.548 -0.751 . . . . 10.0 111.752 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.19 -29.23 70.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.993 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.96 -65.35 0.22 Allowed 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.472 0.916 . . . . 10.0 113.472 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -80.18 33.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.896 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.78 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 112.744 -0.142 . . . . 10.0 112.744 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -56.41 22.57 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 8' ' ' LEU . 2.0 tp -57.6 -34.84 69.68 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.78 HE21 ' N ' ' A' ' 6' ' ' GLY . 45.0 mt-30 -61.41 -37.19 82.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.045 0.45 . . . . 10.0 111.058 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -84.87 -41.95 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.52 -39.69 94.36 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.252 0.464 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.18 94.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.729 0.299 . . . . 10.0 111.011 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.83 -30.53 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.237 0.542 . . . . 10.0 110.475 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.07 -3.24 57.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.744 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.19 -41.0 5.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.426 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 0.2 OUTLIER -161.61 133.14 5.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.834 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.0 mt -99.69 100.41 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HB3' HD22 ' C' ' 83' ' ' LEU . 23.5 ttpt -108.89 101.66 45.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 10.0 111.283 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.55 71.36 4.68 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.308 2.672 . . . . 10.0 110.717 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 mttm -128.22 177.92 6.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.064 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -83.89 144.57 29.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.093 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.13 105.21 18.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.733 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.011 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -112.13 140.12 23.19 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 179.23 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.754 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 57.8 Cg_exo -40.36 132.53 2.31 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.47 2.78 . . . . 10.0 112.772 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.729 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.8 Cg_endo -59.11 141.36 98.03 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.282 2.655 . . . . 10.0 112.876 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.413 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -80.05 135.15 55.17 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.251 179.071 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.44 -7.5 21.39 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 122.862 2.375 . . . . 10.0 112.812 -178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -38.89 80.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.394 -0.367 . . . . 10.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 t -122.29 -117.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.23 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 7.5 ptp180 -166.75 49.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.992 0.425 . . . . 10.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.417 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.4 tttm -148.52 150.61 33.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.803 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.729 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.0 pp -74.47 156.03 37.38 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.769 0.319 . . . . 10.0 111.002 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -98.91 170.64 8.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.62 -179.079 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -119.16 125.72 49.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.011 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -166.76 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.84 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -174.73 -67.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.825 -0.435 . . . . 10.0 109.825 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.672 -0.68 . . . . 10.0 110.293 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.863 0.363 . . . . 10.0 110.579 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -81.68 143.08 32.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.039 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -133.22 112.26 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.868 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -97.92 110.15 22.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.167 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.628 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -122.18 153.71 38.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.937 0.399 . . . . 10.0 111.431 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 36.8 mtm -123.87 110.89 15.42 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.451 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.507 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -81.61 113.23 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.32 110.31 21.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.434 0.635 . . . . 10.0 112.635 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.421 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 28.5 ttp85 -103.36 68.63 0.97 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 107.034 -1.469 . . . . 10.0 107.034 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.559 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.8 t-80 66.16 -88.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.909 -1.041 . . . . 10.0 111.144 -178.447 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -96.8 -21.77 17.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.844 0.354 . . . . 10.0 111.455 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -90.1 120.3 31.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.495 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.49 125.13 48.16 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.989 -0.374 . . . . 10.0 109.989 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.598 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 63.8 mt -118.63 118.37 57.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.715 0.293 . . . . 10.0 111.6 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -80.73 115.34 20.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.628 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -112.08 112.32 23.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.076 0.465 . . . . 10.0 112.248 -178.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.62 100.75 13.43 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.639 -1.245 . . . . 10.0 107.639 177.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -120.65 -173.44 2.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.879 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 mmtt -125.88 160.57 29.55 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.03 -25.44 66.91 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.055 0.455 . . . . 10.0 111.203 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -2.18 49.63 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.9 m -86.74 141.28 29.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.685 0.279 . . . . 10.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.0 p -87.91 159.58 18.3 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.544 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 t -63.31 -35.22 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.919 0.39 . . . . 10.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.91 -35.94 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.58 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.401 ' O ' HG13 ' B' ' 30' ' ' ILE . 38.6 mt-10 -63.95 -34.62 78.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.048 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.92 HD11 HD21 ' B' ' 57' ' ' LEU . 78.4 mt -63.73 -44.98 91.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.27 -34.26 77.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.125 179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -65.64 -39.44 91.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.146 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 26' ' ' GLU . 73.7 mt -66.2 -42.73 91.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -63.14 -37.91 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.445 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.64 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.0 OUTLIER -63.67 -33.67 76.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.499 179.581 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.84 -26.57 66.69 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.495 -0.86 . . . . 10.0 112.458 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.4 mt -91.37 -57.49 4.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 70.0 mt -83.45 -15.48 49.44 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.384 0.512 . . . . 10.0 112.384 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 83.8 mttt 64.16 31.72 13.07 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.147 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.452 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 7.6 mmt180 -112.91 132.18 22.44 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.142 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 125.85 10.54 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.695 2.93 . . . . 10.0 113.436 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.64 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 43.1 Cg_endo -68.23 -20.39 43.25 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.938 2.425 . . . . 10.0 112.102 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.33 -31.76 73.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.287 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -98.97 10.86 40.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.036 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -93.67 128.37 39.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.859 0.362 . . . . 10.0 110.825 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.403 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 70.0 mmt-85 -118.72 111.2 18.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.031 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -93.28 121.14 34.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -114.78 122.12 45.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.13 0.49 . . . . 10.0 111.74 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.451 ' HG3' ' CZ ' ' B' ' 62' ' ' PHE . 4.5 tmtm? -118.19 123.52 45.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.401 -0.818 . . . . 10.0 108.833 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 57.4 43.19 23.57 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.443 0.465 . . . . 10.0 111.099 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 69.33 5.92 5.4 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -119.19 147.03 44.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.736 0.303 . . . . 10.0 111.549 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.23 132.47 43.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.521 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.8 mt -78.41 171.07 15.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -83.22 -157.53 0.24 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.603 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.62 -50.65 0.46 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.097 0.475 . . . . 10.0 110.012 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.18 -21.53 54.69 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.842 -0.694 . . . . 10.0 112.845 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -73.97 157.41 36.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.949 0.404 . . . . 10.0 111.013 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.6 p -90.64 169.25 11.16 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.465 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.92 HD21 HD11 ' B' ' 27' ' ' LEU . 79.2 mt -62.07 -35.59 79.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.598 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.04 -22.95 65.44 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.387 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -94.75 -6.53 42.84 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.756 0.313 . . . . 10.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 44.5 m -107.84 23.05 15.06 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.046 0.387 . . . . 10.0 112.046 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.94 28.09 71.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.961 -0.638 . . . . 10.0 113.519 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.451 ' CZ ' ' HG3' ' B' ' 46' ' ' LYS . 45.0 m-85 -107.26 99.41 8.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.904 0.383 . . . . 10.0 110.757 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -124.31 178.05 5.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 6.1 m -75.59 4.97 6.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.502 . . . . 10.0 111.154 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -97.31 -38.15 9.77 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.46 -39.79 18.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.197 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.77 107.52 17.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.776 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.507 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 66.8 mtt180 -118.91 161.74 34.77 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.103 -178.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.507 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 10.7 Cg_endo -53.69 -34.73 75.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.163 2.576 . . . . 10.0 113.264 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.579 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.33 11.37 27.21 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.233 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -151.01 77.09 7.75 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.674 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.1 Cg_exo -76.24 132.2 13.6 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.748 2.299 . . . . 10.0 111.617 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.18 122.79 18.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.546 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -78.46 126.15 30.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.478 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.507 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.3 t -121.77 130.33 74.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.14 135.28 13.52 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.653 -0.784 . . . . 10.0 111.84 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.3 tp -116.36 104.12 11.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.915 0.388 . . . . 10.0 111.333 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.403 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -97.95 119.55 36.77 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 66.3 t80 -98.96 123.16 43.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.286 -0.264 . . . . 10.0 110.286 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -75.03 78.09 2.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.279 0.561 . . . . 10.0 110.754 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.502 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -85.96 136.03 33.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -67.88 128.47 36.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.988 -0.551 . . . . 10.0 112.2 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.27 19.27 9.97 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.677 -0.692 . . . . 10.0 112.398 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.1 m -111.86 112.81 24.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.829 0.347 . . . . 10.0 110.529 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -77.44 -8.51 57.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.752 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.448 ' O ' HG13 ' B' ' 90' ' ' ILE . 54.7 tt0 -60.95 -28.63 69.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.367 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.19 -40.96 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.211 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.94 -21.31 60.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.371 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 30.5 m -83.83 -23.83 31.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.407 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' B' ' 10' ' ' HIS . 29.2 mt -90.53 -33.79 6.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.427 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.19 113.53 11.7 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.686 ' HA ' ' O ' ' B' ' 95' ' ' SER . 57.2 Cg_endo -71.66 -2.67 11.73 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.899 2.4 . . . . 10.0 112.182 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -80.53 -45.72 16.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.353 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -88.64 -28.96 20.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.811 -0.632 . . . . 10.0 111.542 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.686 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.3 m -132.29 136.55 28.26 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.647 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.1 151.24 79.94 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 122.553 2.169 . . . . 10.0 111.539 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.35 127.03 24.2 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.985 2.457 . . . . 10.0 112.12 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.58 120.85 14.13 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.773 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.418 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.5 tp -135.69 132.48 19.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.341 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.546 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 52.8 Cg_exo -58.22 127.7 25.87 Favored 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.635 2.223 . . . . 10.0 111.844 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.85 -36.47 83.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.958 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.424 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.3 m -73.15 -21.76 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.132 0.491 . . . . 10.0 111.104 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.546 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.7 mmm -111.42 62.18 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.65 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 83.7 tttt -131.27 -55.08 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.851 0.685 . . . . 10.0 112.851 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -74.74 62.42 5.62 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.484 2.123 . . . . 10.0 111.793 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -130.98 -178.24 4.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.915 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.574 ' HB2' HE22 ' B' ' 118' ' ' GLN . 1.2 t0 -90.35 177.69 6.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.873 0.368 . . . . 10.0 111.82 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 12.7 m -107.36 132.73 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.675 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 109' ' ' GLY . . . . . 0.498 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -85.15 -150.59 13.05 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.984 -0.627 . . . . 10.0 113.133 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.02 -41.76 11.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.002 0.429 . . . . 10.0 111.295 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.5 m -79.91 166.12 21.97 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.684 -179.326 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -73.55 127.9 34.01 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.0 t30 74.97 13.96 3.26 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.613 0.571 . . . . 10.0 110.954 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.498 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 28.4 tt0 -85.84 121.61 28.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -106.4 146.06 30.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.081 0.467 . . . . 10.0 111.545 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -119.1 105.4 11.36 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.238 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.34 127.23 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.537 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' GLN . . . . . 0.574 HE22 ' HB2' ' B' ' 107' ' ' ASP . 21.0 mp0 . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.091 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.918 0.389 . . . . 10.0 110.729 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.661 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -109.12 119.07 38.42 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.056 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 16.7 mt -96.18 117.84 31.55 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 179.177 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mp -103.63 113.2 39.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.791 0.329 . . . . 10.0 110.222 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.8 p -83.26 176.24 9.3 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.875 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.1 m -72.04 -7.06 46.66 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -93.82 -2.38 53.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.045 0.45 . . . . 10.0 109.832 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.71 9.7 80.65 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 10.0 111.867 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.12 123.09 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.676 0.274 . . . . 10.0 110.627 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.661 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 14.4 mt-10 -94.87 114.48 26.35 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.686 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 94.7 m-85 -104.07 107.08 17.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.598 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 10.8 mm -89.4 114.89 28.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.627 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.1 t -103.63 128.23 57.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.424 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -60.06 134.13 56.75 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.629 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 66.1 ttt180 -57.52 -28.81 63.81 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -55.51 -38.16 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.913 0.387 . . . . 10.0 111.139 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -95.09 -26.38 16.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.304 0.573 . . . . 10.0 110.148 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 18' ' ' ALA . . . . . 0.629 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -64.26 -33.51 75.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.632 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 75.2 mt -58.39 -51.5 69.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.229 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.548 ' O ' HG13 ' C' ' 24' ' ' ILE . 24.0 m -65.47 -41.26 93.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.432 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 24.3 m -58.39 -41.68 85.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.857 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.32 -15.36 81.21 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.982 -0.628 . . . . 10.0 112.575 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 38.7 m -82.13 -31.86 30.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.008 0.432 . . . . 10.0 110.166 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 24' ' ' ILE . . . . . 0.548 HG13 ' O ' ' C' ' 20' ' ' THR . 22.1 mt -69.87 158.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.205 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -71.4 87.03 0.85 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.078 0.466 . . . . 10.0 110.988 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -107.24 166.01 10.95 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.167 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.0 mmm -79.03 42.91 0.49 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.937 0.347 . . . . 10.0 111.937 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.34 -18.18 60.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.221 0.534 . . . . 10.0 110.427 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 15.9 m -101.05 14.59 31.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.85 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.97 -61.18 5.42 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.105 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.48 161.06 21.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.28 1.987 . . . . 10.0 111.968 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.71 23.82 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.943 -0.571 . . . . 10.0 112.621 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -127.27 113.56 16.46 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.939 0.4 . . . . 10.0 111.398 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -91.27 94.42 9.53 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.8 172.28 9.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -63.5 -14.93 55.94 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.593 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -55.78 22.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.775 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.414 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.6 tp10 -67.24 -31.64 72.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.939 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -62.57 -24.26 67.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.034 0.445 . . . . 10.0 111.034 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.37 -53.43 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.278 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -128.09 105.26 8.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.841 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.414 HG22 ' O ' ' C' ' 38' ' ' GLU . 4.1 t -84.22 121.59 36.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.796 0.331 . . . . 10.0 110.737 -179.576 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -90.39 103.82 16.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.71 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -98.19 112.88 24.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.182 0.515 . . . . 10.0 111.533 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -106.12 144.21 33.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 67.69 22.1 9.08 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.752 0.657 . . . . 10.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.2 mt -128.36 107.97 19.34 Favored Pre-proline 0 C--O 1.237 0.396 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.664 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -63.46 148.14 92.81 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.966 2.444 . . . . 10.0 111.837 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.1 p -59.76 -39.62 85.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.511 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 50' ' ' HIS . . . . . 0.464 ' CE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -53.57 -58.56 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 113.006 0.743 . . . . 10.0 113.006 -179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.408 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.3 m -62.71 -36.67 76.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 10.0 111.324 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 27.0 tp -64.09 -36.06 82.78 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.691 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 19.9 m -63.0 -40.6 98.26 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.292 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -66.79 -37.27 84.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.395 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.408 HG23 ' O ' ' C' ' 51' ' ' VAL . 89.6 t -62.26 -47.26 93.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.779 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -61.24 -39.2 89.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.838 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.0 mtm -65.01 -42.24 94.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.045 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -67.11 -39.79 86.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.416 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.512 ' O ' HG23 ' C' ' 63' ' ' VAL . 1.4 m-85 -60.89 -48.81 80.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.163 -0.472 . . . . 10.0 109.899 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 25.7 m -59.16 -40.92 87.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.214 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.579 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 27.8 t80 -64.01 -43.08 96.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.455 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -66.61 -34.22 77.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.166 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.512 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.1 t -62.17 -46.4 96.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -74.57 -38.05 62.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.804 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 12.8 t80 -58.59 -52.17 66.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.677 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -83.76 42.01 0.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.218 0.532 . . . . 10.0 110.539 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -152.77 -62.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.583 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.62 -36.02 1.45 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.909 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 20.4 m -82.5 43.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 111.932 -179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 -5.01 48.91 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.603 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -92.0 -7.8 47.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.029 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 pt -102.38 161.9 21.89 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.467 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -65.67 164.48 26.44 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.749 2.3 . . . . 10.0 112.534 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.4 168.25 11.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.273 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -51.19 131.32 32.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 122.314 0.246 . . . . 10.0 110.971 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.5 124.45 15.18 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.131 2.554 . . . . 10.0 112.313 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.3 pt -83.64 45.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 10.0 111.231 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.624 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.22 -53.91 0.19 Allowed Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.956 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.624 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 14.8 Cg_exo -69.72 98.87 0.71 Allowed 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.062 1.841 . . . . 10.0 110.725 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 18' ' ' LYS . 44.3 mt-10 -68.69 3.61 1.81 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.042 0.756 . . . . 10.0 113.042 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 81' ' ' ILE . . . . . 0.488 ' HA ' ' OE1' ' C' ' 84' ' ' GLU . 20.2 mm -77.66 -2.94 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.522 0.677 . . . . 10.0 110.625 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.5 -28.94 67.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.622 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 18' ' ' LYS . 8.8 tp -77.51 -22.58 50.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.861 0.362 . . . . 10.0 110.846 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.488 ' OE1' ' HA ' ' C' ' 81' ' ' ILE . 9.1 mp0 -64.79 -26.14 68.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 10.0 109.651 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 mt -75.91 -27.31 57.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.703 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 9' ' ' GLN . 0.5 OUTLIER -68.65 -20.99 64.48 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.437 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.6 -23.62 67.46 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.915 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 88' ' ' ALA . . . . . 0.661 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -57.98 -44.35 87.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.347 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.82 -58.57 0.39 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -78.59 19.64 0.48 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.999 0.37 . . . . 10.0 111.999 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.661 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 81.1 m-85 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.98 -0.533 . . . . 10.0 109.638 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.489 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 111.801 -0.52 . . . . 10.0 111.801 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.575 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -57.82 -59.72 4.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.651 0.612 . . . . 10.0 112.651 -179.229 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.693 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.5 tp -65.66 -37.38 86.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.461 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -58.25 -24.5 59.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.146 0.498 . . . . 10.0 111.101 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -98.85 -46.78 5.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.104 0.478 . . . . 10.0 110.496 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.579 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 97.1 mt -63.43 -34.83 78.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.06 92.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.727 0.299 . . . . 10.0 111.324 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.3 tp -68.14 -28.85 67.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.522 . . . . 10.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.56 -10.29 59.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.283 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.3 -36.04 10.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.21 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.605 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.2 tp -151.1 121.72 7.46 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.265 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 mp -86.63 92.62 3.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.68 -0.859 . . . . 10.0 108.68 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' C' ' 83' ' ' LEU . 81.1 tttt -106.28 105.9 55.54 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.006 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -98.0 64.68 0.09 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.386 2.724 . . . . 10.0 110.802 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -124.8 170.84 10.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.018 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -77.44 145.49 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.529 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.881 HD11 HD23 ' C' ' 83' ' ' LEU . 44.2 mm -116.28 99.61 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.219 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.833 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 40.9 tttp -104.92 142.05 23.84 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 107.662 -1.236 . . . . 10.0 107.662 178.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -36.1 130.92 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.586 2.858 . . . . 10.0 112.912 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.805 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 10.6 Cg_endo -52.93 137.66 61.37 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.568 2.845 . . . . 10.0 113.165 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 125.08 83.31 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.252 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.95 -15.58 48.56 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.08 2.52 . . . . 10.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.19 -35.08 79.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.464 -0.335 . . . . 10.0 111.181 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -130.0 -127.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 109.996 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.506 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 4.9 ptp180 -155.22 52.29 0.61 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.136 0.493 . . . . 10.0 111.02 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -149.17 151.36 34.2 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.805 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -74.74 148.47 40.43 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.124 -0.324 . . . . 10.0 110.124 178.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.527 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -84.92 155.17 21.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.369 -179.466 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -107.59 110.82 22.8 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.833 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 21.7 t70 -162.43 -77.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.55 -69.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.731 -1.128 . . . . 10.0 109.397 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mmm . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.758 0.313 . . . . 10.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.3 141.16 35.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.119 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.417 HG11 HD13 ' B' ' 57' ' ' LEU . 79.6 t -117.06 116.08 50.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.096 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.67 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 56.4 m-85 -104.08 114.75 29.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.346 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.562 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.1 pt? -134.27 158.33 44.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.878 0.37 . . . . 10.0 111.445 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.585 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.8 mtm -125.94 117.03 22.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.418 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.4 mm -87.49 112.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -108.92 109.3 20.34 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -99.81 73.77 1.8 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.388 -1.338 . . . . 10.0 107.388 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.604 ' HB2' HG12 ' B' ' 90' ' ' ILE . 6.9 t-160 66.63 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.362 -0.835 . . . . 10.0 111.18 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -108.91 -24.55 11.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.947 0.404 . . . . 10.0 110.905 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.4 m -86.06 107.77 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.89 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -110.66 123.47 50.07 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.423 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.794 HG12 HD12 ' C' ' 12' ' ' ILE . 20.5 mt -118.72 122.19 68.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.758 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' PHE . . . . . 0.512 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 52.6 t80 -79.84 121.68 25.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.562 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.2 m -112.11 118.36 35.17 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 10.0 111.607 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.874 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.0 t70 -104.09 93.58 4.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.155 -1.054 . . . . 10.0 108.155 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.2 -167.95 1.36 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.479 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -127.58 166.37 18.16 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -62.61 -23.12 66.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.892 0.377 . . . . 10.0 111.6 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.98 -9.58 59.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.716 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 3.7 m -81.19 142.81 32.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.69 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 57.7 p -92.21 169.6 10.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.617 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.4 t -69.7 -34.9 63.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.089 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -63.57 -35.05 79.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.349 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -62.17 -36.14 80.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.764 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.671 HD11 HD21 ' B' ' 57' ' ' LEU . 84.6 mt -60.87 -45.36 94.86 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -60.46 -40.03 89.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.053 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -62.66 -41.08 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.572 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -66.79 -47.8 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.271 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -61.6 -36.53 73.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 10.0 110.53 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.721 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.2 OUTLIER -60.51 -36.41 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.029 179.451 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.98 -5.88 89.37 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 121.063 -0.589 . . . . 10.0 112.791 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 69.4 mt -107.48 -50.2 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.792 0.33 . . . . 10.0 110.81 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 30.5 mt -87.14 -9.58 54.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 10.0 111.767 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.03 50.15 12.58 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.503 0.502 . . . . 10.0 111.474 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.58 142.25 31.11 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.512 -179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.85 128.83 16.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.498 2.799 . . . . 10.0 113.102 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.721 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 60.0 Cg_endo -71.86 -24.94 20.56 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 123.027 2.485 . . . . 10.0 112.743 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 t0 -68.99 -23.05 64.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.933 0.397 . . . . 10.0 111.038 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -90.7 -2.99 57.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.592 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -88.85 135.8 33.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.955 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.518 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 60.3 mmt-85 -125.46 110.81 14.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.217 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 90.4 mt -91.79 120.79 32.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.881 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -114.36 118.69 34.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.081 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.471 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 47.4 tttm -123.06 130.56 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.901 -0.777 . . . . 10.0 108.901 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 61.23 33.76 19.02 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.068 0.461 . . . . 10.0 110.242 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 65.55 21.89 11.76 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.477 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -130.78 149.15 52.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.781 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.471 HD11 ' HD2' ' B' ' 43' ' ' ARG . 48.1 tp -78.13 131.42 37.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.733 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -80.15 150.76 30.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.504 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.71 124.37 39.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.817 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.22 -33.6 65.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.41 -22.49 67.4 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.821 -0.704 . . . . 10.0 113.81 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.11 157.77 23.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.245 0.545 . . . . 10.0 111.796 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 26.3 p -94.19 167.49 11.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.467 178.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.671 HD21 HD11 ' B' ' 27' ' ' LEU . 43.9 mt -59.08 -43.16 91.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.764 0.316 . . . . 10.0 111.724 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.52 -35.44 72.79 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.952 -0.642 . . . . 10.0 113.061 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -79.4 -17.83 53.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.809 0.337 . . . . 10.0 111.298 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.3 m -90.47 6.57 42.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.649 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.22 16.64 53.12 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.565 -0.826 . . . . 10.0 112.716 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 44.3 m-85 -92.04 90.31 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.837 0.351 . . . . 10.0 110.145 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 39.4 p -116.02 176.83 4.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' B' ' 68' ' ' ARG . 0.7 OUTLIER -69.99 -0.13 6.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 10.0 111.592 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -95.0 -51.14 4.79 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.861 0.362 . . . . 10.0 110.241 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.99 -25.46 43.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.931 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.67 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -119.25 95.88 4.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.135 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' B' ' 64' ' ' SER . 26.9 mtm180 -119.0 156.79 51.85 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.767 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.401 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 31.9 Cg_endo -65.32 -15.14 48.61 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.419 2.079 . . . . 10.0 111.228 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.45 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -101.39 -7.48 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.605 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.647 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.84 92.08 1.56 Allowed Pre-proline 0 C--O 1.235 0.297 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.675 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.585 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.7 Cg_exo -80.56 130.28 7.79 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.904 2.403 . . . . 10.0 111.376 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.55 127.29 30.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.626 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m -85.78 127.18 34.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.056 0.455 . . . . 10.0 111.617 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.2 t -121.74 133.24 68.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.382 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.04 137.64 17.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.775 -0.726 . . . . 10.0 111.577 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 tp -116.89 109.63 17.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.071 0.463 . . . . 10.0 111.887 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.69 151.7 20.44 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -128.37 123.37 33.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.746 0.307 . . . . 10.0 110.808 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -74.64 89.18 2.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.177 0.513 . . . . 10.0 111.191 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -119.78 129.87 54.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.588 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.04 137.62 49.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.038 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 69.5 13.21 8.33 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.596 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.6 m -116.92 96.21 5.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.621 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.23 -8.83 57.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.708 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.459 ' O ' HG13 ' B' ' 90' ' ' ILE . 33.4 tt0 -60.11 -31.56 70.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.451 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.32 88.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.161 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.43 -21.6 64.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 16.2 m -84.04 -18.14 38.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.111 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.604 HG12 ' HB2' ' B' ' 10' ' ' HIS . 43.4 mt -91.48 -29.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.856 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.58 116.06 23.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.217 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.452 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.79 -14.36 44.24 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.004 2.469 . . . . 10.0 111.953 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -91.86 -15.61 27.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 10.9 m -103.17 -30.94 10.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.885 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 69.2 m -148.68 147.1 23.74 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.6 138.78 50.88 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.311 2.008 . . . . 10.0 111.282 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.92 125.42 8.25 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.217 2.611 . . . . 10.0 111.75 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -56.09 113.46 1.54 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.634 -0.712 . . . . 10.0 111.873 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.2 tp -143.87 125.41 8.16 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.419 -0.809 . . . . 10.0 109.279 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 24.9 Cg_exo -64.83 123.72 12.07 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.8 2.333 . . . . 10.0 111.997 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -63.21 -30.28 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.176 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -66.77 -14.01 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.297 0.57 . . . . 10.0 110.116 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 78.4 mmm -123.08 34.8 5.03 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.606 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 30.3 tttm -105.6 -49.1 0.12 Allowed Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 113.029 0.752 . . . . 10.0 113.029 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.606 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 70.1 Cg_endo -73.67 63.02 4.71 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.0 1.8 . . . . 10.0 112.688 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.531 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 39.1 mt-30 -133.6 150.31 51.61 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.092 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.74 148.98 45.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.584 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.8 m -76.17 141.52 41.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.979 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -84.88 -144.15 6.66 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.52 -37.04 12.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.119 0.485 . . . . 10.0 110.658 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.647 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 66.4 m -80.65 161.94 24.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.671 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.83 126.68 28.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.016 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 66.06 14.71 9.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.064 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 31.3 tt0 -76.43 136.2 39.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.799 0.333 . . . . 10.0 110.176 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -115.37 144.41 43.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.812 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -130.33 113.15 14.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.007 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.531 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -76.39 126.33 36.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.44 -0.346 . . . . 10.0 110.392 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.474 -0.33 . . . . 10.0 111.534 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.065 0.46 . . . . 10.0 111.321 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.559 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -118.07 115.93 25.84 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.766 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.6 mt -87.8 124.33 33.51 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.774 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 15.4 mt -107.61 113.07 42.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -83.82 166.26 18.1 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.653 -0.249 . . . . 10.0 111.019 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -68.69 -10.52 56.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.493 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -84.48 -11.84 55.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.157 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.98 28.46 20.83 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.147 -0.781 . . . . 10.0 111.147 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -106.46 133.09 51.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.171 -0.307 . . . . 10.0 110.171 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.559 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 25.2 mt-10 -98.2 129.82 44.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.354 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -123.23 101.12 7.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.68 0.276 . . . . 10.0 110.634 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.794 HD12 HG12 ' B' ' 14' ' ' ILE . 45.3 mt -94.06 125.62 46.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 4.5 t -107.64 148.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.904 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.874 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 58.2 tttt -59.56 138.18 57.78 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.119 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -51.56 -43.73 62.49 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.277 0.473 . . . . 10.0 112.277 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.569 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.5 tt0 -56.84 -52.17 66.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.396 . . . . 10.0 111.51 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -65.79 -41.29 92.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.775 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.87 96.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.398 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 65.7 mt -62.6 -48.24 80.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.71 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 8.7 m -60.74 -41.16 94.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 36.4 m -67.59 -31.72 71.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.429 . . . . 10.0 110.561 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.79 -9.84 83.2 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.932 -0.651 . . . . 10.0 112.151 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -84.03 -17.97 38.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.055 0.455 . . . . 10.0 110.109 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.8 mt -80.3 157.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.674 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -73.34 78.1 1.36 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.201 0.524 . . . . 10.0 110.524 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.575 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -94.58 170.75 9.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.458 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.489 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 92.2 mmm -78.34 31.41 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.249 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mp -68.59 -26.12 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.158 0.504 . . . . 10.0 110.503 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 7.6 m -95.71 15.73 19.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.199 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.0 -61.31 3.8 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.378 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.82 166.61 15.6 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.713 2.275 . . . . 10.0 111.464 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.03 -66.64 2.71 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.31 -0.471 . . . . 10.0 113.551 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -126.05 120.9 31.45 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 122.39 -0.476 . . . . 10.0 111.415 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -95.65 90.96 5.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.35 166.6 22.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.702 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -63.8 -33.97 76.86 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -63.53 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.759 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.461 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.1 mp0 -72.69 -24.0 60.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.432 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -80.3 -19.26 47.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.26 0.552 . . . . 10.0 109.929 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -94.09 -59.95 1.85 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.979 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -105.83 89.18 3.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.087 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.461 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.4 t -84.89 94.66 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.109 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 43' ' ' ASN . . . . . 0.403 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 21.0 t-20 -82.18 119.12 23.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.049 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -104.56 124.16 48.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.545 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -105.08 140.5 38.16 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.934 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 69.52 19.78 7.37 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.878 0.736 . . . . 10.0 111.011 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -127.04 107.5 21.92 Favored Pre-proline 0 C--O 1.236 0.389 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.98 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.506 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 27.5 Cg_exo -64.97 158.75 49.82 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 123.269 2.646 . . . . 10.0 112.13 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -67.37 -41.52 84.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.266 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -57.41 8.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.518 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.509 ' HB ' HD21 ' C' ' 85' ' ' LEU . 32.4 m -65.56 -35.25 74.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.674 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -66.66 -34.69 78.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -60.16 -42.92 95.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.73 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 46.8 tttp -65.9 -35.18 79.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.458 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.441 HG23 ' O ' ' C' ' 51' ' ' VAL . 66.8 t -65.41 -44.57 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.736 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 54.8 m -61.18 -42.65 98.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.687 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.4 mtm -66.63 -38.91 87.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.726 179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.579 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.9 t80 -62.09 -43.84 97.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.587 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.3 m-85 -65.13 -43.35 92.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.262 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 75.3 m -57.85 -43.78 86.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.415 0.626 . . . . 10.0 109.584 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' B' ' 70' ' ' GLN . 14.0 t80 -67.07 -42.8 84.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.133 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -59.97 -39.12 84.53 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.232 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.421 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -59.4 -50.08 81.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.004 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.1 mmt180 -71.96 -37.24 69.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.653 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 83.3 t80 -59.03 -42.36 90.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.965 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.6 13.65 15.36 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.758 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -117.2 -56.34 2.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.331 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.12 -20.44 0.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.611 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 13.7 m -84.15 27.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.127 0.489 . . . . 10.0 111.512 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 -11.2 59.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.278 0.561 . . . . 10.0 110.128 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -77.42 -22.63 51.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.326 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.744 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 37.0 pt -100.37 165.88 13.63 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.031 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.744 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 58.6 Cg_endo -71.11 171.2 16.38 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.306 2.004 . . . . 10.0 113.241 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.64 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 5.9 tp10 -71.51 173.68 7.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.147 -0.933 . . . . 10.0 108.904 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.64 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 17.5 t80 -54.01 130.26 58.27 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 76' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 73.1 Cg_exo -51.71 131.79 38.95 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.135 2.557 . . . . 10.0 112.914 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.605 HG22 ' HA ' ' A' ' 16' ' ' LEU . 16.7 pt -84.14 37.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.915 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.439 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -90.18 -54.58 0.29 Allowed Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.55 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.439 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 34.6 Cg_endo -65.49 116.94 4.19 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.758 1.639 . . . . 10.0 111.681 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -69.58 -2.39 11.36 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.44 94.9 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.221 0.534 . . . . 10.0 110.452 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.502 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -161.51 -42.46 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.619 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.881 HD23 HD11 ' A' ' 22' ' ' ILE . 8.4 tp -68.43 -24.85 64.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.687 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 26.9 mp0 -63.27 -35.64 81.01 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.887 -1.051 . . . . 10.0 108.946 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.693 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -78.97 -34.36 44.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.264 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.421 HD13 HD12 ' C' ' 83' ' ' LEU . 5.4 tt -64.46 -30.23 71.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.221 -0.9 . . . . 10.0 110.034 179.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 29.0 ttp -62.53 -18.16 61.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.44 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.56 83.06 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.593 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.94 -51.67 0.53 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.453 0.908 . . . . 10.0 113.453 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -78.81 13.54 1.66 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.878 0.371 . . . . 10.0 111.49 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.876 0 CA-C-O 118.786 -0.626 . . . . 10.0 109.435 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 CA-C-O 120.196 -0.224 . . . . 10.0 112.916 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.58 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.18 -67.37 0.4 Allowed 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.871 0.323 . . . . 10.0 111.871 -179.374 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.631 HD23 ' HB3' ' C' ' 85' ' ' LEU . 9.4 mp -63.87 -34.79 78.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 10.0 110.392 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -52.45 -34.97 51.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.694 -0.685 . . . . 10.0 111.185 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -100.32 -40.77 7.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.566 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.505 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 79.7 mt -64.18 -39.86 94.88 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.064 0.765 . . . . 10.0 113.064 -178.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.31 -30.64 69.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.628 0.252 . . . . 10.0 111.382 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.4 -32.58 73.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.151 0.5 . . . . 10.0 110.192 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.65 56.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.553 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.04 -26.63 15.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.761 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.9 OUTLIER -164.93 118.99 1.29 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.644 179.684 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.3 mt -86.02 97.03 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.544 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 76.8 tttt -113.29 97.01 41.65 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.186 -178.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -88.22 59.14 2.88 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.854 2.369 . . . . 10.0 111.631 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.544 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 34.3 mttm -111.66 177.31 4.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.786 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -81.06 151.97 28.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.719 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.413 HD11 ' CD2' ' C' ' 83' ' ' LEU . 44.9 mm -116.05 110.79 32.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.143 0.497 . . . . 10.0 111.351 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -126.87 137.38 30.43 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.642 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 18.1 Cg_exo -32.7 137.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 124.27 3.313 . . . . 10.0 114.297 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.763 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.4 Cg_endo -58.87 131.13 40.17 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.056 2.504 . . . . 10.0 112.217 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' H ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -71.72 123.21 89.08 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.643 179.772 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 -9.2 21.76 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.995 2.463 . . . . 10.0 111.876 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -31.63 72.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.103 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 ' HG2' ' A' ' 30' ' ' ARG . 14.0 t -134.78 -100.06 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.609 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.1 ptp180 176.81 53.66 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.191 0.597 . . . . 10.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 tttm -149.52 149.19 30.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.45 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.763 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.4 159.6 33.72 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.931 0.396 . . . . 10.0 110.861 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -108.83 179.47 4.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.874 -179.202 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.424 ' H ' HG22 ' A' ' 33' ' ' THR . 41.5 mt-10 -124.6 130.2 51.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.84 0.352 . . . . 10.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.7 OUTLIER -168.37 -74.08 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.632 179.568 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.439 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.07 -56.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.851 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.621 -0.704 . . . . 10.0 110.261 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.7 tmm? . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 120.976 0.417 . . . . 10.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.0 143.29 31.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.346 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -127.49 118.31 49.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 120.992 0.425 . . . . 10.0 110.264 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.526 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 62.4 m-85 -105.37 113.09 26.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.45 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.541 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -128.38 156.99 42.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.809 0.338 . . . . 10.0 111.354 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.498 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 64.6 mtm -125.21 108.37 11.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.529 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.504 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.4 mm -81.33 104.34 9.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.419 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -100.49 102.04 13.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.522 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 29.7 ttp85 -89.25 65.8 7.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.535 ' HB2' HG12 ' B' ' 90' ' ' ILE . 9.1 t-160 68.73 -77.94 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.145 -0.934 . . . . 10.0 110.645 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -108.54 -15.81 14.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.986 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -97.56 99.35 10.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.243 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -98.17 113.68 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.738 0.304 . . . . 10.0 110.561 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.5 mt -108.36 119.2 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.909 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' PHE . . . . . 0.526 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 76.1 t80 -80.66 124.24 28.84 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.815 -0.439 . . . . 10.0 109.815 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.541 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -117.93 122.28 42.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.041 0.448 . . . . 10.0 112.093 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.861 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.7 t70 -104.47 99.25 8.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.818 -1.178 . . . . 10.0 107.818 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.55 -167.89 1.6 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.844 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -123.45 160.39 27.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.22 -26.72 67.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.956 0.408 . . . . 10.0 111.954 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.89 -10.75 59.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.983 -0.553 . . . . 10.0 112.062 -179.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 17.8 m -72.86 143.16 47.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 10.7 p -90.37 157.91 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.722 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -60.72 -36.75 73.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 10.0 111.165 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.9 -30.59 70.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.833 179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.18 -36.76 85.22 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.27 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.51 HD11 HD21 ' B' ' 57' ' ' LEU . 78.3 mt -61.23 -43.08 99.46 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.534 -0.543 . . . . 10.0 109.534 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -61.71 -38.52 88.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.168 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 61.9 mtp180 -65.87 -39.49 90.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.818 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 99.0 mt -65.96 -46.31 88.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.58 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 70.0 t -62.15 -38.1 80.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.753 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.816 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 2.2 tm-20 -61.54 -37.1 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.08 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.02 -4.35 77.53 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 120.972 -0.633 . . . . 10.0 112.895 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 84.4 mt -112.68 -54.03 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.725 0.298 . . . . 10.0 111.23 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.9 mt -82.39 -14.66 54.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.239 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 63.4 mttt 58.0 48.68 12.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.757 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -137.27 139.98 29.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.328 -0.851 . . . . 10.0 110.072 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -43.85 123.87 4.24 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.923 3.082 . . . . 10.0 113.665 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 39' ' ' PRO . . . . . 0.816 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.5 Cg_endo -71.4 -16.53 31.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.924 2.416 . . . . 10.0 111.848 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.69 -38.48 85.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.216 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.468 ' HA ' ' NH2' ' B' ' 43' ' ' ARG . 7.8 mm-40 -96.61 14.18 25.69 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -178.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.89 127.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.489 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 26.1 mmt-85 -112.95 108.23 17.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.567 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.3 mt -90.71 112.37 24.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.087 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' B' ' 93' ' ' PHE . 35.1 m-85 -108.06 117.38 34.0 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.546 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.7 tttm -132.23 138.33 47.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.301 -1.0 . . . . 10.0 108.301 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 63.39 27.98 15.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.446 0.466 . . . . 10.0 109.871 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 67.12 17.24 10.38 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.464 -0.789 . . . . 10.0 111.613 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -129.49 166.11 20.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.9 tp -89.91 130.54 36.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.577 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' B' ' 46' ' ' LYS . 82.9 mt -72.71 158.2 36.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.226 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.493 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 18.0 t0 -100.54 127.15 46.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.956 -179.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -66.24 -28.2 68.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.597 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.1 8.18 79.94 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.109 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 97.5 mttt -116.79 159.71 21.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.865 0.364 . . . . 10.0 110.817 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.2 p -92.06 170.47 9.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.613 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.536 ' O ' ' HB2' ' B' ' 62' ' ' PHE . 26.3 mt -62.72 -42.45 99.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.79 -33.8 69.06 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.165 -0.54 . . . . 10.0 112.589 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -80.03 -13.64 59.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.678 0.275 . . . . 10.0 111.572 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 59.9 m -99.62 16.27 23.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.949 0.404 . . . . 10.0 111.633 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.17 11.85 77.62 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.728 -0.748 . . . . 10.0 113.199 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 29.9 m-85 -86.84 96.86 10.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 117.061 0.431 . . . . 10.0 110.186 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 156.83 31.89 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 50.7 m -60.86 -22.28 64.1 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.183 0.438 . . . . 10.0 112.183 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -76.43 -37.36 57.14 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.812 0.301 . . . . 10.0 111.812 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -39.32 18.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.196 0.522 . . . . 10.0 109.674 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.56 82.1 1.99 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.283 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -89.67 157.76 46.22 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.029 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.28 -21.24 71.17 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.609 2.206 . . . . 10.0 111.819 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CG ' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.67 4.05 23.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.794 179.598 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.569 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -155.83 80.23 4.05 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.613 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.498 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.7 Cg_exo -74.7 144.83 31.92 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.889 2.392 . . . . 10.0 111.99 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 120.74 19.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.816 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.46 120.93 21.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.465 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.504 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.0 t -118.77 133.84 64.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.19 137.64 14.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.626 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.81 107.93 14.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.969 0.414 . . . . 10.0 111.578 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.489 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -103.55 138.83 39.7 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.183 -0.673 . . . . 10.0 109.183 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -114.79 121.75 44.25 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -74.57 82.87 2.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 10.0 111.849 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.21 122.32 43.97 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -66.01 145.88 55.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.338 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.93 24.79 14.74 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.875 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.3 m -132.09 112.34 12.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.207 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -69.82 -19.1 63.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.052 0.453 . . . . 10.0 111.198 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.8 tt0 -54.64 -33.2 60.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.217 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.55 -30.26 69.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.769 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 14.0 mt -92.18 -9.92 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.316 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 43.0 m -87.23 -35.62 18.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.917 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.535 HG12 ' HB2' ' B' ' 10' ' ' HIS . 3.6 mt -89.54 14.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.234 0.54 . . . . 10.0 110.825 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.94 103.85 46.41 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.548 ' HA ' ' O ' ' B' ' 95' ' ' SER . 18.8 Cg_exo -67.97 -3.86 11.36 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.338 2.692 . . . . 10.0 112.054 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.422 ' HB2' ' CE1' ' B' ' 45' ' ' TYR . 39.5 t80 -75.65 -27.62 58.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.998 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 68.7 m -124.31 -35.56 2.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.239 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.548 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 58.8 m -103.42 151.54 38.65 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.419 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.49 157.84 32.56 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.553 2.169 . . . . 10.0 111.441 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 132.87 31.43 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.268 1.979 . . . . 10.0 111.4 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -68.67 108.97 3.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.069 0.462 . . . . 10.0 111.424 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 19.2 tp -138.57 125.43 13.05 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.35 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.3 Cg_exo -60.75 135.01 57.25 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.81 2.34 . . . . 10.0 112.698 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.34 -38.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.971 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 m -68.24 -18.2 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.236 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.455 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.8 mmm -115.45 51.03 0.95 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.468 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.567 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 60.7 tttm -119.38 -53.87 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -179.184 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.567 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.8 Cg_exo -76.77 67.62 7.32 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.499 2.133 . . . . 10.0 111.903 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.577 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 56.0 mt-30 -133.4 162.15 32.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.517 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.499 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.8 t0 -79.91 178.03 8.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.021 0.438 . . . . 10.0 111.356 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.88 131.13 43.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.25 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.68 -153.37 15.46 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.95 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.36 -29.77 17.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.098 0.475 . . . . 10.0 110.739 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.4 m -93.74 159.68 15.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.83 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 112' ' ' ALA . . . . . 0.569 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -69.85 134.22 48.24 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.347 -0.982 . . . . 10.0 108.347 178.303 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.03 -5.96 2.08 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.566 0.541 . . . . 10.0 111.46 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.1 tt0 -74.16 127.34 32.7 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.845 0.355 . . . . 10.0 110.466 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -109.69 139.8 44.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 116' ' ' ALA . . . . . 0.499 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -99.62 101.93 13.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.361 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.577 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -70.5 109.24 2.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.101 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.445 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.699 0.285 . . . . 10.0 110.985 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -101.68 105.43 16.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.641 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 36.5 mt -91.1 113.44 25.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.808 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 33.3 mt -100.6 119.4 48.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -93.09 166.24 12.44 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.673 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -16.97 44.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -85.67 -3.77 58.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.799 0.333 . . . . 10.0 110.729 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.59 18.28 60.45 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.584 -0.817 . . . . 10.0 112.713 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 135.9 33.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -104.65 113.23 26.67 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.999 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.641 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 97.4 m-85 -102.87 113.02 26.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.692 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 22.3 mm -98.82 117.91 44.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -103.83 137.97 30.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.544 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.861 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 74.5 tttt -60.02 134.44 57.05 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -51.69 -43.6 62.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.854 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -51.89 -51.61 55.6 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.96 0.41 . . . . 10.0 111.744 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -74.22 -37.28 63.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.332 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.63 95.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.479 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.74 -49.6 77.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.815 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.407 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.1 m -63.15 -36.61 84.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.981 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.2 m -67.16 -33.14 74.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 10.0 110.407 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.1 -11.69 84.65 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.398 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 -18.26 47.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 10.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -83.75 160.53 3.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.394 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -73.74 86.43 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.136 0.493 . . . . 10.0 111.059 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.24 173.44 6.79 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.829 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.724 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 90.0 mmm -78.58 31.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.873 0.323 . . . . 10.0 111.873 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 tp -65.25 -31.99 73.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.568 . . . . 10.0 109.809 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.5 14.19 19.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.466 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.6 -60.29 5.51 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.865 -0.607 . . . . 10.0 113.185 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.91 179.76 2.56 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.345 2.03 . . . . 10.0 112.461 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.21 -55.44 18.7 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.289 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -142.13 121.29 12.99 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.784 -0.245 . . . . 10.0 110.824 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.91 91.24 5.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.6 159.83 26.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.047 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -60.58 -25.37 66.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.497 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.2 -35.1 71.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.073 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.05 -28.77 64.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.388 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.02 -16.11 60.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -85.12 -52.38 5.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.385 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -129.56 99.06 5.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.376 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -83.52 114.72 24.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.628 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -90.33 109.11 20.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.869 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -106.76 94.47 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 10.0 111.374 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 45' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 86.8 mtt180 -89.89 156.71 18.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 46' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 12.2 mm-40 70.95 16.6 6.47 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.234 0.54 . . . . 10.0 111.305 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 75.8 mt -130.15 117.94 18.19 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.708 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.574 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 24.6 Cg_exo -65.55 138.83 56.13 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.791 2.327 . . . . 10.0 111.806 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -59.95 -40.85 90.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -50.04 61.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.902 -0.59 . . . . 10.0 112.392 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.0 m -73.87 -27.4 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 120.942 -0.303 . . . . 10.0 111.593 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.86 -39.36 93.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.512 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -35.34 72.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.86 0.362 . . . . 10.0 110.791 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.14 -35.11 77.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.116 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.0 t -67.24 -47.44 81.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 35.9 m -59.56 -40.53 87.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.462 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -65.69 -42.51 91.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.849 179.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.505 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 71.6 t80 -65.44 -40.58 93.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.817 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.404 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.3 m-30 -61.7 -47.34 85.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.925 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.5 m -60.58 -42.21 96.23 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.972 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CG ' ' HB3' ' B' ' 70' ' ' GLN . 21.2 t80 -62.86 -42.53 99.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.325 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -64.13 -37.54 87.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.167 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.407 HG22 ' HB ' ' C' ' 20' ' ' THR . 54.2 t -61.82 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.006 0.431 . . . . 10.0 110.089 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.2 mmt180 -72.79 -42.31 64.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.185 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.494 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 88.7 t80 -57.25 -48.44 78.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 50.06 1.7 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.208 0.528 . . . . 10.0 110.771 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -162.16 -58.44 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.297 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -130.1 -36.92 1.5 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.981 0.42 . . . . 10.0 111.647 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.494 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 11.2 m -83.9 37.22 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.68 8.09 23.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.5 0.667 . . . . 10.0 109.694 179.248 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -99.52 -2.34 36.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.523 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.71 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 42.1 pt -115.91 166.54 12.09 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.71 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 73.4 Cg_endo -75.57 172.36 16.47 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.371 2.047 . . . . 10.0 112.718 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.56 170.32 9.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.036 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 57.2 t80 -53.94 130.63 57.96 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.766 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 76' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 52.8 Cg_exo -54.07 118.62 5.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.994 2.463 . . . . 10.0 112.197 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' ' 16' ' ' LEU . 22.9 pt -81.18 42.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.657 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -89.32 -59.47 0.25 Allowed Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 58.0 Cg_endo -72.09 111.16 3.11 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.707 1.604 . . . . 10.0 111.365 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.549 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.52 56.37 2.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.681 -178.84 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 3.9 mm -120.08 9.8 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.465 0.65 . . . . 10.0 110.549 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -88.28 -26.03 22.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.095 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.472 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 tp -70.87 -27.58 63.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.069 0.461 . . . . 10.0 109.816 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.471 ' HA ' HD23 ' A' ' 32' ' ' LEU . 15.0 mp0 -61.39 -31.65 71.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.668 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.631 ' HB3' HD23 ' A' ' 8' ' ' LEU . 27.5 mt -77.5 -35.99 53.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.349 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.2 -23.81 65.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.579 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 87' ' ' MET . . . . . 0.443 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 38.6 ttp -57.49 -26.95 62.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.27 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.59 -30.85 71.64 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.57 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.87 -65.54 0.28 Allowed 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -82.9 36.56 0.5 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.352 0.501 . . . . 10.0 112.352 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.724 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 12.2 m-85 . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.128 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.685 -0.166 . . . . 10.0 112.685 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -63.74 1.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -179.097 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' C' ' 85' ' ' LEU . 11.1 tp -62.74 -27.93 69.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.501 -179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.546 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 5.7 mt-30 -58.98 -26.86 64.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.349 0.595 . . . . 10.0 110.765 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -105.01 -38.73 6.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.199 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.515 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 85.8 mt -62.86 -38.8 92.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.406 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.33 84.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.682 0.277 . . . . 10.0 110.802 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 tp -67.49 -27.73 67.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.366 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.02 -17.98 44.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.157 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.8 -48.83 6.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.603 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HA ' HG22 ' C' ' 77' ' ' ILE . 1.4 tp -149.8 124.63 9.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.407 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -95.73 93.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.112 -0.699 . . . . 10.0 109.112 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.425 ' CD ' ' HB2' ' C' ' 80' ' ' GLU . 28.1 ttpt -98.01 116.75 65.61 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.226 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -90.83 38.18 0.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.951 2.434 . . . . 10.0 111.972 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.421 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 57.2 mttm -94.95 166.58 11.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.237 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -79.03 154.84 29.15 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.597 HD11 HD23 ' C' ' 83' ' ' LEU . 47.3 mm -118.41 105.93 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.06 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 39.5 tttp -122.75 143.46 40.25 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 23' ' ' LYS . 33.0 Cg_exo -29.6 130.07 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 124.557 3.505 . . . . 10.0 114.326 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.712 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.34 135.4 67.73 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.393 2.729 . . . . 10.0 113.026 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -74.66 128.33 85.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.839 179.794 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -68.95 -13.62 37.02 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.099 2.533 . . . . 10.0 112.986 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.06 -35.67 80.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.974 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -129.78 -122.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.995 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -160.2 58.09 0.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.19 0.519 . . . . 10.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.43 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.8 tttm -152.31 154.56 35.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.682 -0.69 . . . . 10.0 109.256 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.712 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -77.69 152.78 33.57 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.744 0.306 . . . . 10.0 110.536 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.552 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 2.5 m -87.34 149.22 24.65 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.231 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -105.11 99.71 9.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.851 0.358 . . . . 10.0 110.285 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.6 t70 -149.78 -74.76 0.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.148 -0.478 . . . . 10.0 109.959 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.69 -68.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 179.002 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.3 m0 . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.255 179.342 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.412 ' HA ' ' OE2' ' B' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.051 0.453 . . . . 10.0 110.334 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.51 132.36 35.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.707 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 3' ' ' VAL . . . . . 0.419 HG11 HD13 ' B' ' 57' ' ' LEU . 57.5 t -121.4 116.57 50.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.707 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.562 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.8 m-85 -107.35 113.24 26.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.759 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -128.01 158.4 38.0 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.866 0.365 . . . . 10.0 111.323 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.614 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 57.3 mtm -128.51 109.25 11.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.642 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.479 HD13 ' HB ' ' B' ' 75' ' ' VAL . 40.9 mm -83.51 110.14 17.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -107.86 108.1 19.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -91.69 71.48 5.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.593 -1.262 . . . . 10.0 107.593 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.574 ' HB2' HG12 ' B' ' 90' ' ' ILE . 8.5 t-160 67.19 -77.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.482 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 73.3 mmtt -110.27 -7.61 14.82 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -106.36 104.49 14.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.519 0.2 . . . . 10.0 111.394 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.5 m -101.04 118.08 36.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.783 0.325 . . . . 10.0 110.568 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.525 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.8 mt -110.86 123.85 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.743 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' PHE . . . . . 0.529 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 86.6 t80 -81.08 125.17 29.87 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.759 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -118.07 119.2 34.03 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.161 0.505 . . . . 10.0 111.6 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -104.91 101.55 11.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.318 -0.993 . . . . 10.0 108.318 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.72 -171.2 2.32 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.89 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -124.35 162.41 23.86 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.412 ' OE2' ' HA ' ' B' ' 1' ' ' MET . 56.2 mt-10 -61.11 -22.94 65.13 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.345 0.498 . . . . 10.0 112.345 -179.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -2.07 47.04 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -91.88 144.54 25.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.531 0.205 . . . . 10.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 32.3 p -93.31 167.31 11.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.078 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.593 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.5 t -66.3 -34.54 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.865 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -62.14 -36.37 81.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 10.0 110.357 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.66 -33.2 75.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.835 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.958 HD11 HD21 ' B' ' 57' ' ' LEU . 69.7 mt -63.39 -45.95 88.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 10.0 109.928 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.52 -32.54 73.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.529 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -64.79 -37.46 87.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.037 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -69.01 -44.48 81.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.44 -33.64 57.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.482 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 32' ' ' GLU . . . . . 0.544 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 29.7 tt0 -59.8 -34.22 72.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.96 -0.563 . . . . 10.0 111.058 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.7 -19.29 58.39 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.542 -0.837 . . . . 10.0 112.844 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.7 mt -89.24 -57.91 3.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 10.0 111.66 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 39.8 mt -91.86 -8.12 47.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.854 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 85.1 mttt 58.78 51.2 7.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.368 0.604 . . . . 10.0 110.817 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 25.5 mmt180 -125.02 133.65 25.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.052 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.37 125.57 19.25 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.928 2.418 . . . . 10.0 112.294 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.69 -21.84 73.04 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.225 2.616 . . . . 10.0 113.059 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -64.39 -33.23 75.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.1 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 12.7 mm-40 -94.14 -2.77 52.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.059 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -82.64 126.85 32.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.54 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 86.7 mmt-85 -120.02 110.86 17.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' B' ' 51' ' ' LEU . 54.0 mt -92.86 118.08 30.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.905 0.383 . . . . 10.0 111.062 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -112.98 117.57 32.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.724 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.504 ' HB3' HD21 ' B' ' 51' ' ' LEU . 14.4 tmtt? -128.99 137.69 51.5 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.317 -0.994 . . . . 10.0 108.317 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 66.28 27.25 10.21 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.514 0.509 . . . . 10.0 109.749 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 67.89 17.07 9.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.773 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -132.12 169.79 15.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 41.7 tp -85.24 135.07 34.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.955 0.407 . . . . 10.0 111.202 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' B' ' 46' ' ' LYS . 65.2 mt -79.0 150.23 32.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.532 179.325 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 14.7 t0 -92.19 113.64 25.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.0 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.593 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.4 m-20 -58.02 -28.01 64.08 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.651 0.611 . . . . 10.0 112.651 -179.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.64 -11.62 68.16 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.425 -178.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 59.4 mttp -95.29 153.74 17.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.968 0.413 . . . . 10.0 110.796 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 32.6 p -83.37 165.54 19.18 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.23 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.958 HD21 HD11 ' B' ' 27' ' ' LEU . 74.4 mt -58.35 -44.73 88.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.16 -33.07 64.04 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.451 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.57 -29.57 52.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.946 0.403 . . . . 10.0 111.086 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' CYS . . . . . 0.494 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 36.9 m -83.58 14.37 3.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 111.696 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 81.66 12.35 81.72 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 121.081 -0.581 . . . . 10.0 112.905 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.494 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 61.3 m-85 -87.79 85.7 7.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.003 0.43 . . . . 10.0 110.321 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 47.1 p -114.42 165.23 12.95 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.435 -0.58 . . . . 10.0 109.435 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 9.7 m -65.54 -5.15 7.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.897 0.379 . . . . 10.0 111.971 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -81.8 -46.35 14.31 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.233 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.31 -35.14 18.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.937 179.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.562 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -101.35 93.31 5.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.275 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -109.43 157.84 36.23 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.666 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.61 -17.17 58.7 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.402 2.068 . . . . 10.0 111.518 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.13 -5.76 21.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.507 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -157.54 89.48 2.44 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.723 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.614 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 4.6 Cg_exo -79.14 138.29 14.19 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.966 2.444 . . . . 10.0 111.941 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.67 117.45 8.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.533 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -80.1 125.59 30.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.086 0.47 . . . . 10.0 111.672 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.479 ' HB ' HD13 ' B' ' 7' ' ' ILE . 32.0 t -119.3 139.27 47.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.456 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.18 131.25 10.54 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.582 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.439 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 52.0 tp -109.64 99.36 8.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.873 0.368 . . . . 10.0 111.321 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.452 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.51 113.42 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 80.3 t80 -96.05 117.35 30.5 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.64 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -71.87 91.57 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.224 0.535 . . . . 10.0 111.221 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -99.64 129.96 45.83 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.19 129.88 41.7 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.38 19.86 11.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.624 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 2.0 m -117.08 112.96 21.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.853 0.359 . . . . 10.0 110.127 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -74.09 -6.37 47.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.127 0.788 . . . . 10.0 113.127 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.4 tt0 -62.91 -32.6 73.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.935 0.398 . . . . 10.0 111.341 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.95 -37.45 74.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.89 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.25 -15.27 61.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.928 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.92 -26.06 17.77 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.574 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.7 mt -84.11 -11.82 11.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 10.0 110.982 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -85.67 113.36 50.74 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.847 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.4 Cg_exo -66.68 -14.94 45.91 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.047 2.498 . . . . 10.0 111.827 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -74.0 -37.38 64.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.262 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -96.67 -44.86 6.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.817 0.341 . . . . 10.0 111.021 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.9 m -111.45 138.98 21.57 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.657 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.04 153.75 76.77 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.386 2.057 . . . . 10.0 111.519 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -52.51 126.85 22.07 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.036 2.491 . . . . 10.0 112.575 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -70.31 107.29 3.69 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.259 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 24.0 tp -138.77 126.74 13.64 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.91 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.9 Cg_exo -60.13 127.01 21.74 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.589 2.193 . . . . 10.0 111.778 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.66 -31.26 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.735 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 20.7 m -67.5 -14.67 18.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.683 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.5 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 79.9 mmm -114.51 10.69 16.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.129 0.49 . . . . 10.0 109.873 179.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 25.4 ttpt -78.27 -53.42 1.35 Allowed Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 112.834 0.679 . . . . 10.0 112.834 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.9 Cg_exo -76.93 71.43 6.2 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.474 2.116 . . . . 10.0 112.356 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.529 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 53.6 mt-30 -135.73 167.73 20.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.0 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.62 159.3 19.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.944 0.402 . . . . 10.0 111.735 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -82.82 138.22 34.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -93.64 -174.7 39.97 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 121.085 -0.578 . . . . 10.0 112.312 179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -33.18 67.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.992 0.425 . . . . 10.0 111.546 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.653 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.0 OUTLIER -85.25 159.55 20.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.166 -179.363 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.56 121.73 15.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.332 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.28 13.53 6.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.921 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.571 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.2 tt0 -73.36 128.66 36.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -106.4 130.42 54.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.799 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.97 107.81 16.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.352 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.529 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -72.05 126.7 33.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.085 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.3 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.022 0.439 . . . . 10.0 110.775 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 2' ' ' LYS . . . . . 0.596 ' HD3' ' HG2' ' C' ' 41' ' ' GLU . 85.0 tttt -110.57 119.0 37.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.742 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.468 HD22 ' HE2' ' C' ' 44' ' ' PHE . 43.2 mt -99.92 129.83 46.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.058 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 37.4 mt -113.5 119.91 62.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.7 p -89.64 168.36 12.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.178 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -69.15 -16.57 63.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.825 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -81.05 -16.71 52.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.94 0.4 . . . . 10.0 110.542 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 98.7 13.25 41.32 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.409 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -90.82 130.37 36.79 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.821 -0.436 . . . . 10.0 109.821 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -98.7 134.3 41.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.106 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -124.31 123.25 39.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.675 0.274 . . . . 10.0 111.29 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.525 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 33.2 mm -102.14 114.56 41.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 t -97.63 141.43 15.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.414 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -61.8 121.97 14.2 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.42 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 37.5 ttt-85 -51.36 -39.91 58.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.764 0.653 . . . . 10.0 112.764 -178.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -58.37 -52.37 65.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.809 0.337 . . . . 10.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -68.46 -33.01 73.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.091 0.472 . . . . 10.0 110.49 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.82 88.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.688 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 85.2 mt -61.67 -45.28 94.7 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.883 -0.414 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.45 -38.64 91.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.975 178.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -65.53 -36.78 84.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.286 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.72 -8.49 81.77 Favored Glycine 0 C--N 1.33 0.209 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.334 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 18.7 m -81.36 -20.96 39.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.393 0.616 . . . . 10.0 109.578 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.7 mt -84.06 159.03 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.175 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -76.11 81.19 2.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.143 0.497 . . . . 10.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.28 -163.19 0.85 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.876 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 83.9 mmm -101.76 27.39 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.64 -0.254 . . . . 10.0 111.453 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.91 -36.45 84.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.265 0.555 . . . . 10.0 110.495 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.2 m -91.58 14.32 15.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.397 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -57.75 4.94 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-N 115.823 -0.626 . . . . 10.0 113.16 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.44 -160.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.686 2.258 . . . . 10.0 111.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.37 -110.64 0.16 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.78 -0.724 . . . . 10.0 112.285 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -86.69 123.97 32.44 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 122.753 -0.263 . . . . 10.0 110.612 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -101.25 74.99 1.6 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.005 0.431 . . . . 10.0 110.105 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.15 158.44 33.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.335 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.03 -27.77 63.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.03 -35.82 77.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.02 0.438 . . . . 10.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -84.87 -21.7 29.66 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.74 -0.663 . . . . 10.0 109.824 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.1 m -77.72 -40.11 42.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.517 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -68.0 -47.31 68.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.862 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.596 ' HG2' ' HD3' ' C' ' 2' ' ' LYS . 37.1 mt-10 -124.82 90.43 3.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.18 115.63 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.886 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -91.98 111.96 23.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.917 0.389 . . . . 10.0 110.804 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.468 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.8 m-85 -97.36 114.85 26.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.112 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' C' ' 45' ' ' ARG . 39.3 mtt180 -100.11 147.13 26.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.221 -0.445 . . . . 10.0 109.887 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 65.52 21.41 11.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.749 0.655 . . . . 10.0 110.839 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 90.0 mt -129.59 109.49 17.42 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-O 121.079 0.466 . . . . 10.0 111.131 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 38.1 Cg_exo -63.77 150.98 87.17 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.135 2.557 . . . . 10.0 112.13 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.2 p -64.99 -38.96 92.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.411 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -54.24 46.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.78 -0.645 . . . . 10.0 112.294 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 51' ' ' VAL . . . . . 0.443 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.3 m -67.81 -34.62 68.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.638 -0.255 . . . . 10.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.53 -37.93 89.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.62 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 53' ' ' SER . . . . . 0.433 ' O ' ' HG3' ' C' ' 57' ' ' MET . 40.8 m -58.05 -40.71 81.62 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.543 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -67.55 -35.59 79.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.567 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.4 t -64.26 -46.49 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.847 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.4 m -60.66 -39.49 88.58 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.158 -0.473 . . . . 10.0 110.628 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 57' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' C' ' 53' ' ' SER . 52.6 mtm -67.29 -41.45 85.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.334 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.515 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -62.11 -42.87 99.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.49 179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.4 m-85 -61.49 -47.2 86.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.266 179.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -61.06 -42.45 98.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.161 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.18 -44.82 90.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.078 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 tptt -59.93 -42.14 93.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.612 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 51.3 t -59.12 -50.94 77.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.313 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 64' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' C' ' 64' ' ' ARG . 9.5 mmt85 -66.9 -42.33 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.733 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.8 -43.75 85.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.231 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 15.88 14.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.115 0.484 . . . . 10.0 111.18 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 67' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 5.8 t30 -111.93 -59.24 2.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.173 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.43 -30.14 0.56 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.389 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 10.4 m -80.82 47.58 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.941 0.4 . . . . 10.0 111.59 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.56 4.61 53.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.602 0.715 . . . . 10.0 110.018 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -80.83 -26.03 37.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.05 -0.977 . . . . 10.0 109.656 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 72' ' ' ILE . . . . . 0.653 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 29.4 pt -96.15 167.28 12.69 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.787 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 73' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 97.9 Cg_endo -80.34 179.88 5.78 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.276 1.984 . . . . 10.0 112.574 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 74' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.6 tp10 -69.65 168.64 14.42 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.651 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.433 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 31.4 t80 -48.23 127.57 12.41 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 122.382 0.273 . . . . 10.0 111.624 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -48.46 128.15 17.26 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.657 2.905 . . . . 10.0 113.614 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.481 HG22 ' HA ' ' A' ' 16' ' ' LEU . 13.2 pt -83.08 50.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.383 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.514 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -100.2 -57.59 0.13 Allowed Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.514 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 54.7 Cg_endo -69.9 120.13 6.95 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.605 1.537 . . . . 10.0 111.098 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.425 ' HB2' ' CD ' ' A' ' 18' ' ' LYS . 4.5 pt-20 -71.44 -8.18 52.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mm -79.54 83.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.491 0.662 . . . . 10.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 -41.98 0.16 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.867 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.597 HD23 HD11 ' A' ' 22' ' ' ILE . 11.8 tp -68.1 -25.57 65.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.506 -0.77 . . . . 10.0 108.981 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 20.9 mp0 -61.17 -36.14 79.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.64 178.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.623 ' HB3' HD21 ' A' ' 8' ' ' LEU . 38.5 mt -74.56 -33.57 62.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.838 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 5.0 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.171 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 28.0 ttp -60.48 -20.98 61.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.672 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.02 -30.56 71.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.449 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.14 -61.68 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.4 41.74 0.63 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.251 0.548 . . . . 10.0 111.369 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.823 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.194 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.406 -0.278 . . . . 10.0 112.406 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' C' ' 25' ' ' LYS . 0.0 OUTLIER -63.07 -61.26 2.5 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.068 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.772 HD21 ' HB3' ' C' ' 85' ' ' LEU . 27.0 tp -62.89 -28.76 70.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.231 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -55.99 -29.7 60.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.489 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -104.89 -34.63 7.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.979 0.418 . . . . 10.0 110.661 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.618 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.8 mt -63.99 -40.82 97.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 10.0 112.0 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' C' ' 86' ' ' LEU . . . -67.49 -29.22 68.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.773 0.321 . . . . 10.0 111.058 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 tp -66.04 -34.88 79.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.332 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.74 -13.44 56.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.543 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.34 -42.11 13.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.239 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.946 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -158.95 116.77 2.84 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.24 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.485 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.5 mt -85.58 88.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.547 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 82.5 tttt -97.62 103.7 17.64 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.737 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.485 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 33.5 Cg_endo -91.57 72.73 0.8 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.248 2.632 . . . . 10.0 111.452 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -131.68 169.71 15.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.497 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -85.09 149.04 25.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.697 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mm -102.02 129.53 53.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.202 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 1.012 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.0 OUTLIER -134.04 145.16 54.55 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.228 -1.027 . . . . 10.0 108.228 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.661 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 45.7 Cg_exo -36.14 131.05 0.36 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.693 2.928 . . . . 10.0 112.678 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.887 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.9 Cg_endo -54.89 152.64 28.22 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 123.401 2.734 . . . . 10.0 113.233 -178.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 mt -74.44 117.99 66.4 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.837 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.15 -23.54 52.8 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.726 2.284 . . . . 10.0 112.287 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.26 61.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.63 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.3 t -108.07 -132.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.27 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.2 ptp180 -158.49 56.29 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 10.0 110.525 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.421 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.9 tttm -152.09 149.75 29.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.334 -0.848 . . . . 10.0 108.876 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.887 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -73.07 154.52 40.39 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.715 0.293 . . . . 10.0 111.108 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.6 m -93.29 165.7 12.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.162 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -113.62 127.74 56.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.592 0.234 . . . . 10.0 110.629 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 1.012 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.5 t70 -172.19 -79.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.795 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.84 -54.44 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 . . . . . 0 C--O 1.247 0.961 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.081 179.944 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmm? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 120.572 0.225 . . . . 10.0 111.482 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.15 115.5 1.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.75 122.11 63.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.272 0.558 . . . . 10.0 111.318 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.517 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 47.4 m-85 -108.13 105.25 14.9 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.629 179.396 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.845 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.4 OUTLIER -113.31 150.4 32.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.031 0.443 . . . . 10.0 111.499 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 6' ' ' MET . . . . . 0.539 ' HB2' ' HB2' ' B' ' 72' ' ' PRO . 38.5 ttm -120.91 101.36 7.64 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.47 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 7' ' ' ILE . . . . . 0.65 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.5 mm -80.94 113.56 20.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -111.63 101.87 10.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.524 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 21.8 ttp85 -89.75 73.63 7.56 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' HIS . . . . . 0.75 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.7 t-80 65.09 -81.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.529 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -114.76 0.37 13.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.787 0.327 . . . . 10.0 111.603 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.524 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -106.72 100.03 9.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.158 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 50.2 m -93.89 127.51 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.866 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.616 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 55.5 mt -123.35 117.34 51.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.305 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -82.69 119.01 23.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' THR . . . . . 0.845 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -113.65 113.01 24.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.203 0.525 . . . . 10.0 112.16 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 17' ' ' ASP . . . . . 0.979 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 6.4 t70 -99.26 99.79 10.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.581 -1.266 . . . . 10.0 107.581 178.159 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.8 -166.18 1.56 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.517 -0.311 . . . . 10.0 111.288 -178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -128.03 158.21 38.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.842 -0.429 . . . . 10.0 109.842 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 5.5 mp0 -56.78 -31.03 64.24 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.365 0.505 . . . . 10.0 112.365 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -17.38 64.68 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 49.5 m -79.43 142.59 35.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.71 0.29 . . . . 10.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.2 p -90.47 167.11 12.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.798 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.417 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -65.12 -32.59 58.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.014 178.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.01 -38.07 89.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.064 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.95 -31.18 72.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.935 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.882 HD11 HD21 ' B' ' 57' ' ' LEU . 85.5 mt -64.85 -42.22 95.07 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.58 -36.12 79.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.648 -0.706 . . . . 10.0 110.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.03 -37.61 87.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.2 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -69.28 -47.8 71.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.538 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.23 -39.4 80.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.638 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -58.79 -38.29 78.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.377 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.25 -11.83 84.65 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.809 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 72.3 mt -103.22 -51.51 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.865 0.364 . . . . 10.0 111.474 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 41.2 mt -84.25 -16.0 44.79 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.494 0.553 . . . . 10.0 112.494 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 mttt 62.05 45.45 7.23 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.531 0.681 . . . . 10.0 110.609 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' B' ' 37' ' ' ARG . 53.4 mtt-85 -133.3 143.66 49.13 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.529 -0.76 . . . . 10.0 109.972 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.79 131.6 46.59 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.12 2.547 . . . . 10.0 112.755 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.05 -16.68 36.4 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.872 2.381 . . . . 10.0 112.036 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.64 -28.21 69.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.434 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -104.93 13.34 31.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.82 0.343 . . . . 10.0 111.812 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -92.48 127.68 38.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.865 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 43.1 mmt-85 -117.37 111.76 19.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.416 -0.357 . . . . 10.0 110.616 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.1 mt -95.97 113.64 25.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.556 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -109.45 115.96 30.92 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.236 0.541 . . . . 10.0 112.435 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -115.43 127.27 55.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.404 -0.816 . . . . 10.0 108.919 178.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 61.91 35.87 16.11 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.51 0.506 . . . . 10.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.15 9.11 7.21 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.394 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -119.7 160.33 22.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.142 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 tp -85.66 139.0 31.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.644 0.259 . . . . 10.0 110.882 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -79.51 170.72 16.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.882 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -112.88 120.47 41.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.945 0.402 . . . . 10.0 110.754 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 0.9 OUTLIER -64.04 -25.99 68.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.297 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.88 13.33 66.29 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.813 -0.708 . . . . 10.0 113.179 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.77 155.17 43.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.034 0.445 . . . . 10.0 111.349 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 24.8 p -87.25 168.58 13.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.166 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.882 HD21 HD11 ' B' ' 27' ' ' LEU . 51.3 mt -60.79 -39.66 89.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.838 0.351 . . . . 10.0 110.654 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.8 -27.71 67.09 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.851 -0.613 . . . . 10.0 112.623 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.0 -26.56 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.061 0.457 . . . . 10.0 110.782 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.0 m -82.46 2.78 31.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.846 -0.615 . . . . 10.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.22 15.95 59.88 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.906 -0.664 . . . . 10.0 113.018 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 41.3 m-85 -86.61 87.39 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.818 0.342 . . . . 10.0 110.789 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.2 p -108.8 170.26 8.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 33.9 m -70.62 -3.78 19.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.079 0.466 . . . . 10.0 111.113 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -88.36 -43.17 11.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -79.05 -30.45 44.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.073 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 67' ' ' ALA . . . . . 0.517 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -118.41 106.57 12.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.03 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.5 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 64.0 mtt180 -113.01 160.08 32.26 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.806 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 12.1 Cg_endo -55.85 -24.47 47.43 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.987 2.458 . . . . 10.0 113.025 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.487 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -115.55 12.97 16.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.707 0.289 . . . . 10.0 111.351 179.396 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -152.83 82.71 4.94 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.741 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.539 ' HB2' ' HB2' ' B' ' 6' ' ' MET . 4.3 Cg_exo -76.03 133.02 14.65 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.884 2.389 . . . . 10.0 111.726 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 114.7 5.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.41 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.56 125.1 26.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.11 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 75' ' ' VAL . . . . . 0.65 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.1 t -124.06 131.01 73.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.27 133.26 11.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.617 -0.801 . . . . 10.0 111.625 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.2 tp -114.7 108.51 16.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.0 0.429 . . . . 10.0 111.453 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.582 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -102.2 141.01 35.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.001 -0.741 . . . . 10.0 109.001 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -119.56 121.63 39.79 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -76.19 96.85 3.99 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.274 0.559 . . . . 10.0 111.456 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -115.43 120.89 41.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.224 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -57.93 132.5 53.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.962 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.28 4.34 4.5 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.369 -0.832 . . . . 10.0 112.693 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 108.79 20.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.11 0.481 . . . . 10.0 110.031 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -82.73 -7.98 59.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.804 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.473 ' O ' HG13 ' B' ' 90' ' ' ILE . 39.0 tt0 -58.45 -29.36 66.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.321 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.8 -38.96 79.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.446 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.04 -27.9 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.539 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 35.0 m -77.14 -26.94 53.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.955 0.407 . . . . 10.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.75 HG12 ' HB2' ' B' ' 10' ' ' HIS . 19.0 mt -88.2 -21.16 7.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.45 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 91' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 46.0 tt0 -76.23 112.56 21.61 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.92 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 92' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' B' ' 95' ' ' SER . 13.2 Cg_exo -71.63 -7.85 22.01 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.043 2.495 . . . . 10.0 111.959 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.57 -19.13 46.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.163 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -121.39 -35.81 3.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.082 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 95' ' ' SER . . . . . 0.613 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.9 m -119.58 143.71 35.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.106 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 96' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 41.6 Cg_endo -70.19 142.84 47.05 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.326 2.018 . . . . 10.0 111.143 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' PRO . 78.5 Cg_exo -49.82 128.4 21.48 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.182 2.588 . . . . 10.0 112.625 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -65.9 111.67 3.41 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.442 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 12.5 tp -137.42 134.91 18.82 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.509 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 100' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 23.9 Cg_exo -65.87 131.09 26.27 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.867 2.378 . . . . 10.0 112.17 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -69.67 -29.69 67.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.092 0.472 . . . . 10.0 110.577 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.439 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.6 m -71.52 -13.01 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.192 0.52 . . . . 10.0 110.76 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 103' ' ' MET . . . . . 0.478 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 83.9 mmm -116.56 17.58 15.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.781 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.604 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 79.9 tttt -85.25 -54.28 0.44 Allowed Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 112.796 0.665 . . . . 10.0 112.796 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 105' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.8 Cg_exo -74.15 73.18 3.87 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.208 1.939 . . . . 10.0 111.747 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 106' ' ' GLN . . . . . 0.478 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 29.4 mt-30 -139.61 162.39 35.21 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.25 167.75 15.36 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.874 0.368 . . . . 10.0 111.804 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 131.91 34.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.258 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.38 -154.99 23.92 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.902 -0.665 . . . . 10.0 112.552 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.32 -32.63 17.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.978 0.418 . . . . 10.0 111.149 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.538 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 36.2 m -89.11 163.73 15.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.371 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.71 129.13 38.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 68.85 15.18 8.95 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.645 0.591 . . . . 10.0 111.62 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.538 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.8 tt0 -81.58 121.64 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -103.12 132.91 49.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.828 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.72 109.0 19.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.6 t -78.61 128.36 38.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 10.0 111.68 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.766 0.317 . . . . 10.0 111.446 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -123.08 113.63 19.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.382 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 3' ' ' LEU . . . . . 0.692 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 28.2 mt -83.84 133.3 34.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.167 -0.47 . . . . 10.0 109.845 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.2 mt -117.92 108.82 25.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.2 p -83.61 166.47 18.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.061 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -14.49 60.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 10.0 111.755 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -86.29 -2.64 58.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 10.0 110.604 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.8 23.8 59.24 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.006 -0.616 . . . . 10.0 111.922 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.85 127.58 44.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -94.26 136.49 34.49 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.796 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 11' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -123.92 102.5 7.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.873 0.368 . . . . 10.0 111.207 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 12' ' ' ILE . . . . . 0.616 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 15.8 mm -87.15 115.04 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.4 t -102.82 139.24 24.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.291 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 14' ' ' LYS . . . . . 0.979 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 49.0 tttt -62.38 133.57 55.24 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 45.0 ttt180 -55.34 -35.86 65.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.869 -179.07 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 16' ' ' GLU . . . . . 0.468 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 62.2 tt0 -54.04 -44.21 70.82 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.102 0.477 . . . . 10.0 110.953 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -81.16 -43.08 19.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.622 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.11 74.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.361 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 19' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.5 mt -64.81 -41.06 96.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.86 0.362 . . . . 10.0 110.765 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 20' ' ' THR . . . . . 0.407 HG21 HG13 ' C' ' 63' ' ' VAL . 3.8 m -65.64 -48.23 72.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 12.3 m -61.01 -33.73 73.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.859 0.362 . . . . 10.0 110.873 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.09 -9.4 71.62 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.052 -0.594 . . . . 10.0 112.345 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 6.0 m -99.44 2.16 44.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.515 0.674 . . . . 10.0 110.052 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.66 160.48 5.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 25' ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 7' ' ' SER . 76.2 tttt -64.95 101.27 0.48 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 10.0 111.144 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 26' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -120.76 166.92 13.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.161 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 27' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 53.6 mmm -76.86 34.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mp -71.61 -25.19 62.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.119 0.485 . . . . 10.0 110.361 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -94.0 16.71 13.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.384 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 30' ' ' GLY . . . . . 0.452 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -83.74 -56.88 2.53 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.42 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 31' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 26.9 Cg_endo -62.03 166.98 11.39 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.602 2.202 . . . . 10.0 112.706 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.53 92.81 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.887 -0.597 . . . . 10.0 113.069 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -152.93 114.79 4.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.81 0.338 . . . . 10.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -82.31 79.74 8.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.842 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.28 163.06 28.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.273 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 36' ' ' GLU . . . . . 0.404 ' HA ' ' OG1' ' C' ' 39' ' ' THR . 33.2 mt-10 -59.67 -19.5 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -64.22 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 38' ' ' GLU . . . . . 0.504 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.0 OUTLIER -69.31 -20.33 63.88 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.547 179.611 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 39' ' ' THR . . . . . 0.404 ' OG1' ' HA ' ' C' ' 36' ' ' GLU . 2.7 m -74.53 -30.77 61.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.02 0.438 . . . . 10.0 110.647 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -94.06 -55.78 3.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.22 92.95 4.27 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 42' ' ' VAL . . . . . 0.576 ' HB ' HD23 ' C' ' 3' ' ' LEU . 1.6 t -85.82 97.01 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.172 -178.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -84.09 111.65 19.51 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.927 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 44' ' ' PHE . . . . . 0.443 ' HB3' HD12 ' C' ' 47' ' ' ILE . 3.0 m-85 -115.72 109.94 18.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -96.74 163.45 12.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.191 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 69.53 7.17 6.09 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.525 0.516 . . . . 10.0 111.72 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 47' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' C' ' 44' ' ' PHE . 60.1 mt -122.76 106.22 34.71 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.121 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 48' ' ' PRO . . . . . 0.5 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 45.9 Cg_exo -58.6 145.02 96.76 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.874 2.383 . . . . 10.0 112.024 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.7 p -58.35 -41.29 84.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.503 -179.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.95 -55.64 28.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.917 -0.583 . . . . 10.0 112.361 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.6 m -67.62 -34.41 67.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 121.077 -0.249 . . . . 10.0 111.61 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.08 -33.51 75.93 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 39.2 m -61.89 -39.75 93.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.403 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -65.68 -37.67 87.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.314 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 55.2 t -63.99 -44.88 97.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.575 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.3 m -61.18 -39.65 90.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.649 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.9 mtm -68.29 -38.04 81.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 58' ' ' TYR . . . . . 0.618 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 76.4 t80 -63.35 -44.11 95.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.76 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 59' ' ' PHE . . . . . 0.41 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.4 m-85 -63.44 -42.92 98.67 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 179.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 78.9 m -59.05 -43.75 91.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.839 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 61' ' ' TYR . . . . . 0.487 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 53.7 t80 -66.29 -43.6 85.88 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.496 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -60.87 -41.17 95.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.666 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 63' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 59' ' ' PHE . 50.5 t -57.58 -47.14 85.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 10.0 110.392 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -75.11 -40.44 59.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.707 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 65' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -58.83 -43.39 90.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.66 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.79 18.79 4.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.148 0.499 . . . . 10.0 111.111 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -123.75 -68.82 0.85 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.028 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.48 -23.29 4.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.969 0.414 . . . . 10.0 111.842 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.795 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 12.3 m -84.46 27.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.207 0.527 . . . . 10.0 111.808 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -0.32 40.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.26 0.552 . . . . 10.0 110.606 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.86 -17.21 33.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.803 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 33.4 pt -103.44 163.3 17.71 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.836 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -69.16 168.91 19.41 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.928 2.419 . . . . 10.0 112.403 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -70.05 166.87 18.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.082 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 75' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 53.1 t80 -52.12 130.01 40.56 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.859 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 76' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 38.6 Cg_exo -58.49 124.14 15.17 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.809 2.339 . . . . 10.0 112.115 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 77' ' ' ILE . . . . . 0.946 HG22 ' HA ' ' A' ' 16' ' ' LEU . 11.1 pt -78.19 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.341 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 78' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.85 -55.84 0.16 Allowed Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 79' ' ' PRO . . . . . 0.619 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 17.4 Cg_exo -68.41 103.71 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.25 1.967 . . . . 10.0 111.483 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 80' ' ' GLU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 3.7 pt-20 -74.58 58.68 0.79 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.511 0.559 . . . . 10.0 112.511 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 14.8 mm -122.2 -4.73 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.187 0.517 . . . . 10.0 110.796 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 82' ' ' ALA . . . . . 0.582 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -69.38 -34.62 74.82 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.155 -0.34 . . . . 10.0 111.582 -179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 83' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 19.3 tp -68.21 -33.2 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 84' ' ' GLU . . . . . 0.562 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 16.8 mp0 -63.01 -36.51 83.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.219 -0.9 . . . . 10.0 109.663 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 85' ' ' LEU . . . . . 0.772 ' HB3' HD21 ' A' ' 8' ' ' LEU . 76.6 mt -74.39 -34.14 63.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.425 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 86' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -68.26 -17.3 64.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.83 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.0 ttp -63.67 -18.27 63.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.793 179.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.51 75.99 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.477 -0.564 . . . . 10.0 109.477 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.71 -68.49 0.14 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.373 -0.831 . . . . 10.0 112.962 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -80.85 47.52 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.345 0.593 . . . . 10.0 111.266 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 91' ' ' PHE . . . . . 0.541 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 10.6 t80 . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 N-CA-C 111.92 -0.472 . . . . 10.0 111.92 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -62.49 1.78 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.778 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -63.24 -31.03 72.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.606 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.484 ' HA ' ' CD1' ' C' ' 86' ' ' LEU . 2.3 tt0 -54.65 -36.45 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.066 0.46 . . . . 10.0 110.972 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -93.45 -39.97 10.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.453 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 90.0 mt -63.42 -29.56 70.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.684 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.27 -40.95 98.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.795 0.331 . . . . 10.0 110.984 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.4 tp -68.04 -31.87 71.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.206 0.527 . . . . 10.0 109.83 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.12 15.71 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.448 -0.796 . . . . 10.0 110.3 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.78 -39.27 2.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.952 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.626 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.3 OUTLIER -164.94 122.6 1.61 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.906 179.418 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.3 mt -89.15 87.51 2.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.65 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 59.3 tttt -100.85 111.33 63.01 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.286 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.96 45.11 0.09 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.332 2.688 . . . . 10.0 111.595 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.526 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 14.4 mttm -95.27 175.77 6.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.131 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.36 152.43 27.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.1 0.476 . . . . 10.0 111.52 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.8 mm -113.51 141.82 28.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.879 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.952 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.4 OUTLIER -160.65 144.59 10.26 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.594 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 50.6 Cg_exo -38.5 136.04 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.331 2.687 . . . . 10.0 112.88 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 25.8 Cg_endo -61.11 134.53 53.23 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 123.119 2.546 . . . . 10.0 112.82 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.24 123.32 87.92 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.254 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.26 -12.72 36.15 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 123.087 2.525 . . . . 10.0 113.074 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -39.54 94.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.122 0.487 . . . . 10.0 110.124 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.545 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.2 t -126.82 -118.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' HG2' HG12 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -163.91 63.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.525 . . . . 10.0 110.476 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.456 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.5 tttm -157.36 153.28 27.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.241 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.3 pp -74.14 148.23 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.736 0.303 . . . . 10.0 110.534 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.638 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.8 m -81.45 163.87 22.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.254 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -111.72 102.22 10.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.748 0.308 . . . . 10.0 110.513 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.952 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -150.67 -82.34 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.301 -0.408 . . . . 10.0 110.613 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.36 -54.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.65 -0.691 . . . . 10.0 109.74 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tmm? . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 121.013 0.435 . . . . 10.0 110.774 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.56 146.67 30.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.813 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.427 HG11 HD13 ' B' ' 57' ' ' LEU . 84.7 t -131.59 118.78 40.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 121.121 0.486 . . . . 10.0 111.362 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.405 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.3 m-85 -108.68 113.86 27.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.94 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.726 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.0 OUTLIER -129.16 159.43 36.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.829 0.347 . . . . 10.0 111.581 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.664 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.9 mtm -127.01 109.02 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.845 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.407 ' CG2' ' HB2' ' B' ' 77' ' ' LEU . 48.5 mm -81.69 103.23 8.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 56.5 ttt180 -101.34 110.94 23.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.382 0.882 . . . . 10.0 113.382 -178.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.423 ' HB2' HD23 ' B' ' 77' ' ' LEU . 5.1 ttp85 -96.18 59.49 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.42 -1.326 . . . . 10.0 107.42 177.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 66.3 -83.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.948 -1.023 . . . . 10.0 112.112 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -93.22 -7.59 44.73 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.282 0.475 . . . . 10.0 112.282 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.47 HG23 ' HB2' ' C' ' 10' ' ' GLU . 2.0 m -120.84 108.41 13.9 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.738 0.273 . . . . 10.0 111.738 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 28.2 m -103.06 120.65 41.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 10.0 110.384 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.624 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.5 mt -108.01 118.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.735 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -77.19 118.56 19.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.726 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.8 OUTLIER -111.61 124.32 52.06 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.119 0.485 . . . . 10.0 111.221 -179.152 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.514 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.0 t70 -110.71 97.63 7.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.36 -167.82 1.62 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.829 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -126.33 164.21 21.54 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.47 -22.96 62.3 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -85.61 -5.23 59.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 13.5 m -82.24 142.71 31.91 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.1 p -90.99 165.38 13.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.779 0.323 . . . . 10.0 110.921 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.532 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 76.7 t -65.62 -34.45 70.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.215 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' B' ' 29' ' ' ARG . 62.1 t80 -61.4 -36.09 79.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -62.69 -38.38 90.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.722 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.652 HD11 HD21 ' B' ' 57' ' ' LEU . 40.4 mt -61.38 -42.99 99.6 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.013 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.88 -37.46 86.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' B' ' 25' ' ' PHE . 62.6 mtp180 -65.82 -34.92 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.041 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 95.2 mt -66.98 -46.31 85.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.04 -37.13 77.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.746 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.56 -39.98 85.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.671 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.6 -1.54 77.37 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.926 -0.654 . . . . 10.0 113.312 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 82.6 mt -114.41 -53.6 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.887 0.375 . . . . 10.0 111.398 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 60.7 mt -90.38 -6.84 54.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.591 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mptt 60.07 38.81 20.35 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.152 0.501 . . . . 10.0 111.678 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.419 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 26.6 mmt180 -116.42 133.1 23.02 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.463 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 44.6 Cg_exo -57.18 133.83 60.12 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 123.073 2.516 . . . . 10.0 112.255 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.5 -22.81 58.43 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.249 2.633 . . . . 10.0 112.614 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -61.5 -37.15 82.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.35 -1.02 57.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.784 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -85.44 135.68 33.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.921 0.391 . . . . 10.0 111.159 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 65.1 mmt-85 -128.0 116.35 19.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.004 178.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 71.7 mt -98.84 118.44 35.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.034 0.445 . . . . 10.0 111.05 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -115.55 112.44 22.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.491 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.55 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.3 tttm -112.78 132.14 55.38 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.68 30.02 19.61 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.107 0.479 . . . . 10.0 110.412 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 68.37 24.19 7.35 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.234 -0.894 . . . . 10.0 111.587 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -130.92 151.47 51.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.127 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.33 130.05 34.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.751 0.31 . . . . 10.0 111.034 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' B' ' 46' ' ' LYS . 95.0 mt -81.93 156.58 24.68 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -99.22 121.99 41.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.739 0.304 . . . . 10.0 110.527 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.532 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 8.5 m-20 -58.51 -29.31 66.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.646 -0.706 . . . . 10.0 112.399 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.57 2.53 84.76 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.002 -0.618 . . . . 10.0 112.872 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -106.94 154.27 21.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.986 0.422 . . . . 10.0 111.177 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 22.5 p -88.78 162.56 16.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.165 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.652 HD21 HD11 ' B' ' 27' ' ' LEU . 24.9 mt -56.98 -36.83 70.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.597 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -34.5 87.14 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.239 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -83.65 -14.12 52.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.049 0.452 . . . . 10.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' CYS . . . . . 0.543 ' HB3' HD22 ' B' ' 51' ' ' LEU . 58.8 m -95.34 6.46 48.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.108 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.96 33.3 37.24 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.404 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.445 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 24.9 m-85 -94.93 55.09 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.096 0.474 . . . . 10.0 110.618 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.19 148.42 48.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m -60.68 -16.77 42.63 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.77 -26.91 34.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.957 0.408 . . . . 10.0 110.341 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.87 -38.87 12.06 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -103.21 82.69 2.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.985 -1.007 . . . . 10.0 108.883 179.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.55 158.21 34.1 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.769 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.69 -15.81 30.18 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.319 2.013 . . . . 10.0 110.696 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.492 ' HB3' ' HE1' ' C' ' 75' ' ' PHE . 0.7 OUTLIER -94.29 -16.57 23.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.939 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.41 93.7 1.41 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.119 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.664 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.6 Cg_exo -72.99 149.73 47.42 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.928 2.419 . . . . 10.0 112.086 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.58 116.29 10.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.017 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.21 115.78 16.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.147 0.499 . . . . 10.0 111.777 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.09 133.46 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -81.68 130.06 9.45 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.017 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.423 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.7 tp -109.74 108.42 18.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.982 0.42 . . . . 10.0 111.197 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.74 123.64 46.05 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.652 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -101.11 118.27 36.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -76.29 121.37 22.86 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.09 0.472 . . . . 10.0 111.658 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.87 149.3 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -79.22 133.69 36.68 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.981 -0.288 . . . . 10.0 110.726 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 t70 75.31 -32.84 0.22 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.894 0.701 . . . . 10.0 112.894 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.8 m -69.53 110.9 5.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.961 0.41 . . . . 10.0 110.562 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -84.96 7.35 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.032 0.444 . . . . 10.0 111.61 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.64 -28.04 68.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.26 92.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.97 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -60.57 -30.62 69.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.541 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 44.2 m -70.08 -26.95 64.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.625 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.432 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 1.5 mt -101.11 2.11 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.832 0.348 . . . . 10.0 111.235 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.49 110.04 44.4 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.202 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' B' ' 95' ' ' SER . 32.0 Cg_exo -62.27 -16.12 49.06 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 123.055 2.503 . . . . 10.0 111.93 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -79.14 1.63 23.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.605 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 16.6 m -142.72 -45.71 0.31 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.501 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.54 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 22.3 m -108.38 133.74 20.47 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.081 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.87 153.63 47.9 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.378 2.052 . . . . 10.0 110.672 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -50.01 120.08 5.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.008 2.472 . . . . 10.0 111.915 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -60.53 121.79 13.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.603 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.1 tp -144.91 122.98 6.54 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 10.0 109.903 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.59 133.78 47.48 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.626 2.217 . . . . 10.0 111.153 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' ASP . . . . . 0.492 ' O ' ' HD3' ' B' ' 105' ' ' PRO . 17.8 t70 -61.21 -35.88 78.39 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 29' ' ' VAL . 23.0 m -69.54 -18.42 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.112 0.482 . . . . 10.0 111.041 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.603 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.7 mmm -110.2 27.91 9.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.506 0.669 . . . . 10.0 109.35 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.457 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 31.1 ttpt -103.22 -49.73 0.15 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.471 -0.786 . . . . 10.0 113.005 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.492 ' HD3' ' O ' ' B' ' 101' ' ' ASP . 5.3 Cg_exo -76.09 51.09 3.03 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.828 2.352 . . . . 10.0 112.16 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.7 mt-30 -123.47 177.3 5.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.594 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.03 -174.4 2.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.728 0.299 . . . . 10.0 111.512 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -93.76 158.31 15.73 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.9 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.6 -137.96 8.28 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.938 -0.648 . . . . 10.0 112.751 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -17.87 22.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.856 0.36 . . . . 10.0 111.532 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 74.7 m -148.86 -174.43 4.62 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.062 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.64 151.19 42.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.67 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.2 t30 73.14 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.354 0.872 . . . . 10.0 113.354 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.458 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 40.1 tt0 -74.28 133.72 42.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.044 0.449 . . . . 10.0 111.702 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -117.09 159.1 23.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.639 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.0 106.29 12.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.946 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 t -73.04 123.97 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.128 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.325 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.972 0.415 . . . . 10.0 110.868 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' C' ' 41' ' ' GLU . 42.6 tttm -114.19 106.11 13.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.606 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.519 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 64.1 mt -89.89 141.37 28.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.671 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.416 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 21.0 mt -126.98 121.55 58.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -95.78 169.69 9.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.946 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -25.19 65.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.038 -0.528 . . . . 10.0 112.424 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -82.18 6.18 17.4 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.667 0.27 . . . . 10.0 111.382 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.99 23.25 76.69 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 10.0 111.638 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -94.67 124.98 39.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.47 ' HB2' HG23 ' B' ' 12' ' ' THR . 21.0 mt-10 -96.53 137.58 35.39 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.266 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.519 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -125.69 113.87 17.91 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.257 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.624 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.1 mm -92.94 116.99 35.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.725 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -103.6 134.64 44.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.686 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.514 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 81.5 tttt -66.1 128.42 36.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.471 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 19.0 ttt-85 -54.57 -27.6 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.821 0.674 . . . . 10.0 112.821 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -57.2 -41.78 80.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.022 0.439 . . . . 10.0 110.702 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 -85.69 -32.7 21.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.206 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -60.71 -40.16 91.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.552 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 99.1 mt -57.46 -44.96 85.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.832 0.349 . . . . 10.0 111.089 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -36.12 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.664 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -66.4 -34.41 77.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.095 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.07 -22.32 75.91 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.31 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -71.47 -28.41 63.92 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.293 0.568 . . . . 10.0 110.216 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 20.9 mt -84.47 141.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -65.38 100.24 0.47 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.931 0.396 . . . . 10.0 110.7 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -101.46 178.01 4.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.491 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.586 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 21.6 mmm -78.22 26.33 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 58.5 mt -74.41 -29.93 61.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.151 0.5 . . . . 10.0 110.256 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -90.44 -0.14 57.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.026 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.93 -62.21 5.7 Favored Glycine 0 CA--C 1.52 0.378 0 CA-C-N 115.765 -0.652 . . . . 10.0 113.348 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.36 174.45 3.41 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.666 2.244 . . . . 10.0 112.52 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.98 -62.12 6.01 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.989 -0.624 . . . . 10.0 112.391 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -130.5 125.9 35.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.808 0.337 . . . . 10.0 111.212 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -109.75 75.7 0.96 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.47 165.8 9.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.332 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -53.54 -39.39 64.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.907 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.08 -39.43 92.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.886 0.374 . . . . 10.0 110.516 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.16 -26.27 65.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.637 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -79.06 -17.87 54.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.315 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -90.78 -55.69 3.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.11 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' C' ' 2' ' ' LYS . 69.8 mm-40 -110.45 96.4 6.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 t -95.1 103.1 14.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.075 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 43' ' ' ASN . . . . . 0.416 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 17.6 t-20 -95.33 122.16 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.085 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.642 ' HB3' HD12 ' C' ' 47' ' ' ILE . 83.7 m-85 -104.21 139.82 38.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.703 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -109.27 138.58 45.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.747 0.308 . . . . 10.0 111.297 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 68.97 8.26 6.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.387 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.642 HD12 ' HB3' ' C' ' 44' ' ' PHE . 85.1 mt -108.54 108.7 61.17 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.277 -0.419 . . . . 10.0 110.501 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.62 149.49 84.02 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.941 2.427 . . . . 10.0 112.046 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 2.6 p -60.28 -38.69 84.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.437 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -55.5 30.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.228 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 21.7 m -66.99 -34.44 69.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.238 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.57 -35.54 81.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.549 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 53' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' C' ' 57' ' ' MET . 46.5 m -61.47 -42.55 98.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.551 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -64.52 -36.74 85.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.39 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 96.1 t -64.75 -46.85 90.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.71 -41.63 97.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.994 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 57' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' C' ' 53' ' ' SER . 44.1 mtm -65.81 -39.58 91.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.511 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.469 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 73.8 t80 -65.27 -41.36 94.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.036 -0.357 . . . . 10.0 110.036 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.6 -46.99 85.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.901 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 32.8 m -58.16 -46.51 85.57 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.722 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -61.37 -46.81 88.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.63 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -61.62 -38.05 86.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.509 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 24.5 t -58.58 -44.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.093 0.473 . . . . 10.0 110.417 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.3 mmt85 -78.28 -41.38 34.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.153 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.553 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 82.7 t80 -57.29 -49.03 77.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.919 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.04 15.18 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.915 0.388 . . . . 10.0 111.437 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 67' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 6.6 t30 -119.09 -75.86 0.58 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.628 0.251 . . . . 10.0 111.078 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.66 17.48 5.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 10.0 111.635 -179.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.553 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 66.2 m -126.25 32.32 5.24 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.021 0.438 . . . . 10.0 111.246 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.88 3.48 33.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 10.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.69 -23.49 49.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.874 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.627 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 47.4 pt -94.87 164.59 19.11 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.608 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.627 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 62.5 Cg_endo -73.48 169.63 21.84 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.394 2.063 . . . . 10.0 111.706 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.62 163.73 10.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.788 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.492 ' HE1' ' HB3' ' B' ' 70' ' ' GLN . 26.7 t80 -46.95 131.7 8.82 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.969 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -57.94 113.27 1.45 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.962 2.442 . . . . 10.0 111.656 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.0 pt -78.71 45.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.742 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.662 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -84.3 -58.01 0.38 Allowed Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.662 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 5.0 Cg_exo -79.98 108.93 2.3 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.202 1.934 . . . . 10.0 111.169 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.65 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -76.93 62.01 2.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.479 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 4.3 mm -119.15 4.28 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.27 0.557 . . . . 10.0 110.611 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.556 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -77.38 -28.74 52.94 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.15 -0.344 . . . . 10.0 111.128 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.6 tp -70.38 -29.8 66.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.476 -0.564 . . . . 10.0 109.476 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 9.1 mp0 -61.99 -33.95 75.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.184 -0.916 . . . . 10.0 109.608 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.778 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -75.63 -32.62 60.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.495 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.484 ' CD1' ' HA ' ' A' ' 9' ' ' GLN . 52.0 tp -69.45 -17.57 63.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.71 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 87' ' ' MET . . . . . 0.458 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 30.5 ttp -64.72 -21.74 66.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.704 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.93 -31.44 72.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.74 -56.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.312 0.856 . . . . 10.0 113.312 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -86.11 56.23 3.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.112 0.482 . . . . 10.0 111.185 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.586 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.879 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 112.213 -0.355 . . . . 10.0 112.213 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.561 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.7 OUTLIER -82.42 -53.67 5.82 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 122.483 0.313 . . . . 10.0 111.797 -179.029 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' C' ' 85' ' ' LEU . 31.7 tp -59.92 -28.64 67.77 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.959 0.409 . . . . 10.0 110.57 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -55.87 -28.97 59.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.132 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -107.11 -36.36 6.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.468 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.559 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.1 mt -60.07 -40.97 91.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.906 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.28 -34.49 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.883 0.373 . . . . 10.0 111.223 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.65 -38.36 90.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.85 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.64 -11.48 59.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.164 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -34.5 14.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.846 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.645 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.6 OUTLIER -159.01 112.31 2.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.098 0.475 . . . . 10.0 111.122 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -81.65 90.91 2.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.557 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 62.8 tttt -101.03 106.96 47.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.273 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -94.7 35.77 0.17 Allowed 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.337 2.691 . . . . 10.0 111.91 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.5 mttm -89.85 175.43 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.113 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -75.42 159.85 30.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.185 0.517 . . . . 10.0 112.022 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.6 mm -115.79 138.23 46.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.917 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.097 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 46.1 tttp -163.96 138.73 4.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -38.91 144.77 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.783 2.989 . . . . 10.0 113.678 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.702 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 37.0 Cg_endo -64.66 154.01 74.53 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.985 2.457 . . . . 10.0 112.785 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.88 126.29 56.1 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.276 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.23 -19.31 63.22 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.272 2.648 . . . . 10.0 112.703 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -35.99 82.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.754 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -130.18 -128.75 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.553 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -156.1 59.76 0.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 10.0 110.441 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.435 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 13.5 tttm -155.66 152.35 28.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.737 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.702 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -74.0 160.04 31.86 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.674 0.273 . . . . 10.0 110.927 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.788 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -102.31 162.69 12.72 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.104 -178.692 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.57 111.45 23.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.699 -0.228 . . . . 10.0 110.874 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.097 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.1 t70 -164.14 -77.57 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.251 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.97 -53.56 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.691 0.62 . . . . 10.0 110.167 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.817 0 CA-C-O 118.301 -0.856 . . . . 10.0 109.691 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.909 0.385 . . . . 10.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -79.39 131.62 36.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.3 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.477 HG11 HD13 ' B' ' 57' ' ' LEU . 90.9 t -118.52 112.99 40.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.184 0.516 . . . . 10.0 110.871 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.692 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 53.7 m-85 -100.2 116.49 32.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.797 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.769 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -129.53 159.62 35.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 10.0 111.763 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 15.6 mtm -125.57 105.33 8.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.811 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.52 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.6 mm -81.15 107.16 13.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -107.39 105.02 14.75 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.553 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 12.8 ttp85 -92.35 74.86 5.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.803 -1.555 . . . . 10.0 106.803 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.637 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.9 t-160 67.29 -82.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.433 -177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -111.29 -10.54 14.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.796 0.332 . . . . 10.0 111.105 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.6 m -92.06 94.95 9.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.565 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.4 m -98.17 112.92 24.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.06 0.457 . . . . 10.0 110.624 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.508 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.0 mt -107.02 119.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -78.33 119.41 21.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.769 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -112.06 118.34 35.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.3 0.571 . . . . 10.0 111.942 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.898 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -103.27 94.81 5.71 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -118.44 -168.57 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.842 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.401 ' O ' HD12 ' B' ' 57' ' ' LEU . 2.2 mmtt -127.17 165.47 19.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -63.36 -22.43 66.87 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.814 0.301 . . . . 10.0 111.814 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 2.7 m -83.1 -8.51 59.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.8 m -77.38 136.77 38.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.077 -0.342 . . . . 10.0 110.077 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 21.1 p -86.14 161.45 18.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.716 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -64.31 -36.53 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.999 0.428 . . . . 10.0 110.337 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -63.99 -30.45 71.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.486 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.69 -35.39 80.62 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.272 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.862 HD11 HD21 ' B' ' 57' ' ' LEU . 47.6 mt -60.95 -42.43 98.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.96 -36.83 82.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.309 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -66.13 -39.16 89.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.949 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -65.73 -48.25 83.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 10.0 109.872 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -63.39 -37.51 79.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.422 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.407 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.4 OUTLIER -59.84 -37.75 80.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.185 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.28 -17.99 79.58 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.938 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.42 -52.15 9.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.983 0.421 . . . . 10.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 34.6 mt -81.44 -17.6 48.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.684 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 63.16 36.47 12.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.802 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -127.87 147.59 63.6 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.76 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.78 130.25 18.77 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.912 3.075 . . . . 10.0 114.134 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 67.4 Cg_endo -76.47 -18.37 15.72 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.846 2.364 . . . . 10.0 111.766 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -65.16 -36.04 82.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.13 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -88.12 0.95 55.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.626 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.22 133.06 34.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.901 0.381 . . . . 10.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.455 ' HB3' ' CE1' ' B' ' 45' ' ' TYR . 83.6 mmt-85 -123.3 110.04 14.7 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 97.2 mt -91.96 116.2 28.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 10.0 111.534 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' B' ' 43' ' ' ARG . 74.8 m-85 -115.19 120.98 41.57 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.02 -0.536 . . . . 10.0 112.027 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.466 ' HB3' HD21 ' B' ' 51' ' ' LEU . 21.0 tttm -121.5 127.26 50.85 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.46 36.98 16.94 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 63.8 20.8 12.39 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.656 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -127.34 146.84 50.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.582 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 tp -79.84 131.67 35.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.341 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' B' ' 46' ' ' LYS . 96.6 mt -76.98 156.33 32.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.885 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -95.56 116.51 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.499 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 50.7 m-20 -59.88 -27.91 67.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.928 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.07 1.5 88.71 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.81 -0.71 . . . . 10.0 113.412 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -113.39 166.3 11.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.583 . . . . 10.0 111.892 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -95.17 171.25 8.85 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.408 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.862 HD21 HD11 ' B' ' 27' ' ' LEU . 77.2 mt -61.83 -40.99 97.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.52 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.32 -30.58 71.5 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.397 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.75 -12.35 59.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.771 0.32 . . . . 10.0 111.352 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' CYS . . . . . 0.446 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 58.3 m -100.69 8.78 43.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.76 0.314 . . . . 10.0 111.556 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.53 1.87 68.22 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.831 -0.7 . . . . 10.0 113.107 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.446 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 82.8 m-85 -79.34 106.98 11.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.813 0.339 . . . . 10.0 110.343 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 1.3 p -137.33 174.41 10.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.138 -0.69 . . . . 10.0 109.138 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.11 -3.55 7.76 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.076 0.465 . . . . 10.0 111.537 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -91.18 -42.81 10.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.165 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.49 -34.16 18.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.762 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.692 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -106.24 107.45 18.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.483 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.512 ' HB2' ' HB3' ' B' ' 71' ' ' ALA . 68.9 mtt180 -120.85 158.5 51.98 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.008 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.504 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 9.7 Cg_endo -53.75 -36.49 82.25 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.132 2.554 . . . . 10.0 113.225 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.524 ' HG3' ' CD1' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.84 13.49 24.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 10.0 111.319 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.512 ' HB3' ' HB2' ' B' ' 68' ' ' ARG . . . -150.99 75.53 8.21 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.442 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.96 136.75 16.84 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.679 2.252 . . . . 10.0 111.284 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 117.22 8.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.699 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 21.7 m -75.17 126.38 30.91 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.334 0.588 . . . . 10.0 111.63 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.52 ' HB ' HD13 ' B' ' 7' ' ' ILE . 33.2 t -122.02 128.19 75.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.164 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.28 126.33 7.36 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' B' ' 9' ' ' ARG . 44.7 tp -104.92 98.78 8.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.918 0.39 . . . . 10.0 111.121 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.38 116.02 28.57 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -95.97 116.8 29.48 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.691 0.281 . . . . 10.0 110.569 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -74.72 109.22 8.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.448 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -130.18 130.64 44.96 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -65.41 136.05 56.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.422 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 20.2 t70 73.1 -7.38 1.51 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.586 -0.734 . . . . 10.0 112.02 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 17.4 m -95.91 100.38 12.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.094 0.473 . . . . 10.0 109.965 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -72.45 -11.32 60.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.191 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.473 ' HG2' HD11 ' B' ' 90' ' ' ILE . 34.6 tt0 -55.66 -31.67 62.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.358 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.964 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.81 -25.53 59.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.842 0.353 . . . . 10.0 111.185 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -87.67 -30.98 19.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.879 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.637 HG12 ' HB2' ' B' ' 10' ' ' HIS . 54.5 mt -78.61 -33.47 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.17 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.48 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 38.0 tt0 -69.46 115.8 36.35 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-O 120.897 0.38 . . . . 10.0 111.677 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.584 ' HA ' ' O ' ' B' ' 95' ' ' SER . 16.3 Cg_exo -69.62 -5.7 16.75 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.471 2.781 . . . . 10.0 112.102 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.48 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 13.8 t80 -68.43 -37.31 80.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.156 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.7 p -108.43 -37.82 5.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.554 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 23.8 m -104.73 141.45 22.57 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.837 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.62 161.78 39.04 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 122.507 2.138 . . . . 10.0 110.719 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.73 135.19 68.28 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.722 2.281 . . . . 10.0 112.398 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -72.79 104.1 3.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 39.4 tp -134.11 121.9 15.9 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.921 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -58.29 127.66 25.63 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.635 2.223 . . . . 10.0 111.665 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.34 -32.83 71.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.362 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.99 -20.23 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.16 0.505 . . . . 10.0 111.192 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 75.3 mmm -113.72 33.16 5.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.846 -0.615 . . . . 10.0 109.638 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.576 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.1 ttpt -97.25 -54.86 0.2 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 113.092 0.775 . . . . 10.0 113.092 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 5.8 Cg_exo -74.09 77.29 2.81 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.554 2.169 . . . . 10.0 112.483 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.592 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.5 mt-30 -139.74 172.37 12.88 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.612 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.453 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 44.9 t0 -89.39 167.38 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.0 m -100.59 135.76 41.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.87 0.367 . . . . 10.0 110.311 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.27 -153.71 12.68 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.792 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.4 p -93.49 -28.71 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 10.0 111.039 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.511 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.2 m -86.04 157.04 20.17 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.616 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.17 122.76 17.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.374 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 72.64 16.7 4.7 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 123.721 0.638 . . . . 10.0 111.791 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.5 tt0 -81.88 126.92 32.47 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -105.54 138.9 40.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.462 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -114.41 106.81 14.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.15 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.592 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -74.34 123.5 29.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.155 179.554 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.236 0.354 0 CA-C-O 120.847 0.356 . . . . 10.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.677 ' HE2' HG12 ' C' ' 4' ' ' ILE . 66.8 tttt -108.43 122.29 46.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 10.0 111.004 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 59.3 mt -99.2 124.99 44.68 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.793 HD11 ' HB3' ' C' ' 41' ' ' GLU . 2.9 mt -108.11 126.52 64.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.3 p -99.46 167.42 10.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.55 -0.295 . . . . 10.0 110.459 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.2 m -66.92 -12.75 60.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 10.0 111.595 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.22 -5.44 59.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.115 0.483 . . . . 10.0 110.266 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.69 16.2 66.42 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.837 -0.697 . . . . 10.0 111.936 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.39 133.22 33.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 10.0 110.573 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.571 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 12.5 mt-10 -100.52 120.82 40.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.761 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.478 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 91.6 m-85 -112.78 114.32 26.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.614 0.245 . . . . 10.0 110.888 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.508 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 25.9 mm -98.2 119.97 46.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 16.8 t -106.28 136.99 38.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.793 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.898 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 55.5 tttt -60.85 128.92 38.87 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.351 -0.386 . . . . 10.0 109.98 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -52.43 -32.89 41.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.394 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.552 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 40.3 tt0 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.629 . . . . 10.0 111.137 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -81.54 -31.11 32.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.154 0.502 . . . . 10.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.14 92.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.737 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 61.7 mt -59.7 -48.99 79.47 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.759 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.563 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -62.79 -42.6 99.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.985 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -62.85 -39.1 93.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.547 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.68 -13.56 82.02 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.525 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 33.1 m -75.36 -26.88 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.218 0.533 . . . . 10.0 110.283 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 18.0 mt -83.49 153.32 3.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -64.67 93.24 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.936 0.398 . . . . 10.0 110.429 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.561 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -99.58 -178.75 3.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.689 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 67.6 mmm -77.58 28.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.641 0.608 . . . . 10.0 112.641 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.85 -28.41 65.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.094 0.473 . . . . 10.0 110.434 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 m -90.39 3.75 52.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.475 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.61 -64.24 3.43 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.695 -0.684 . . . . 10.0 113.461 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.22 175.19 4.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.6 2.2 . . . . 10.0 112.362 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.24 -33.58 64.68 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.293 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -154.47 136.28 14.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.414 . . . . 10.0 110.861 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -118.45 72.48 0.87 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.43 172.71 8.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.365 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -53.17 -31.19 41.4 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.23 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -62.9 -39.67 95.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.038 0.447 . . . . 10.0 110.378 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.543 ' O ' HG22 ' C' ' 42' ' ' VAL . 0.2 OUTLIER -76.54 -29.12 56.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.608 -0.723 . . . . 10.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -73.3 -27.7 61.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.032 0.444 . . . . 10.0 110.562 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -79.14 -57.81 3.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.755 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.793 ' HB3' HD11 ' C' ' 4' ' ' ILE . 28.3 mt-10 -128.61 109.53 11.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.135 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.543 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.6 t -94.2 109.78 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.179 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 13.3 t-20 -90.33 110.85 21.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.914 0.387 . . . . 10.0 110.949 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.591 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.6 m-85 -90.14 125.45 35.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.014 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -99.14 136.6 38.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.344 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 64.33 25.15 13.42 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.686 0.617 . . . . 10.0 111.278 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' C' ' 44' ' ' PHE . 79.1 mt -124.66 103.91 31.16 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.514 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 31.7 Cg_exo -62.04 154.98 58.45 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.289 2.659 . . . . 10.0 112.346 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 13.2 p -65.02 -35.76 82.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -55.4 -57.06 13.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 10.0 112.226 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.463 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.8 m -66.71 -35.76 75.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.388 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 21.4 tp -64.5 -38.95 92.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.742 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 58.9 m -60.74 -41.54 95.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.38 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 54' ' ' LYS . . . . . 0.538 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 54.2 tttp -64.49 -38.33 90.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.624 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' C' ' 51' ' ' VAL . 86.8 t -66.03 -44.76 91.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.074 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.3 m -60.73 -44.33 96.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.803 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.5 mtm -66.62 -36.79 83.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.569 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.559 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.1 t80 -64.7 -41.91 95.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.041 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.428 ' O ' HG23 ' C' ' 63' ' ' VAL . 4.2 m-85 -62.19 -44.72 95.96 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.79 -0.448 . . . . 10.0 109.79 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 24.2 m -60.09 -41.41 92.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.749 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' B' ' 70' ' ' GLN . 20.7 t80 -63.45 -44.69 93.77 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.555 -0.748 . . . . 10.0 109.806 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -63.26 -40.14 96.58 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.371 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.563 HG22 ' HB ' ' C' ' 20' ' ' THR . 49.9 t -59.87 -48.28 88.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.275 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.5 mmt85 -72.67 -38.7 67.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.378 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.444 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 85.4 t80 -57.68 -53.72 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.959 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.2 43.21 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.496 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -155.39 -54.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.174 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.91 -40.12 0.95 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.033 0.444 . . . . 10.0 111.506 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 40.8 m -83.31 53.35 2.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.011 0.434 . . . . 10.0 111.455 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.38 -1.12 45.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.266 0.555 . . . . 10.0 110.342 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 71' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' C' ' 69' ' ' SER . 0.0 OUTLIER -89.55 -22.56 22.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.056 179.705 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.5 pt -90.94 160.98 36.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 72.9 Cg_endo -77.03 176.95 9.49 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.156 1.904 . . . . 10.0 112.819 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -67.12 170.22 7.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.975 -1.011 . . . . 10.0 109.74 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -50.24 130.91 24.52 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.475 -0.329 . . . . 10.0 111.084 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.23 125.11 17.78 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.928 2.419 . . . . 10.0 112.621 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.645 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.5 pt -80.57 52.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.799 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -109.51 -56.34 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.475 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.7 Cg_exo -68.13 106.15 1.31 Allowed 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.968 1.779 . . . . 10.0 112.046 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 37.7 mt-10 -73.46 59.35 0.6 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.105 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 81' ' ' ILE . . . . . 0.659 HD11 ' HA ' ' B' ' 116' ' ' ALA . 10.6 mm -120.48 -7.31 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.573 . . . . 10.0 110.639 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.573 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -67.77 -35.42 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.741 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.557 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 23.9 tp -67.82 -36.15 79.87 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 17.1 mp0 -63.5 -35.75 81.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.116 -0.947 . . . . 10.0 109.64 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.7 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.7 mt -73.56 -35.62 65.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.209 178.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.33 -23.56 67.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.725 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.6 ttp -60.47 -22.04 63.04 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.107 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.52 -34.56 77.13 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.449 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.17 -65.31 0.19 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 124.096 0.873 . . . . 10.0 113.131 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -82.46 55.67 3.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.413 0.625 . . . . 10.0 110.622 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.689 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.3 t80 . . . . . 0 C--O 1.246 0.919 0 CA-C-N 115.163 -0.926 . . . . 10.0 108.75 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.613 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.428 -0.269 . . . . 10.0 112.428 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -66.86 -63.14 1.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -179.044 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.2 tp -61.02 -27.94 68.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.329 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.613 HE21 ' N ' ' A' ' 6' ' ' GLY . 4.5 tt0 -52.6 -34.1 49.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.105 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -106.47 -35.0 7.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.885 0.374 . . . . 10.0 110.648 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.569 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 61.6 mt -59.34 -45.9 90.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.921 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.673 0.273 . . . . 10.0 111.03 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.5 tp -64.22 -37.51 87.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.272 0.558 . . . . 10.0 110.082 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.51 -15.02 53.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.638 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.82 -32.71 31.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.792 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -159.32 114.98 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.618 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 2.0 pt -81.01 94.18 2.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.363 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 79.2 tttt -108.8 95.26 16.37 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.657 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.505 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 1.8 Cg_endo -84.39 78.99 2.66 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.105 2.537 . . . . 10.0 110.936 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 40.1 mttm -130.05 -170.49 2.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.387 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.673 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 49.1 mm-40 -94.16 164.71 12.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.669 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.3 mm -114.56 159.23 14.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.058 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.023 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER 179.92 142.0 0.34 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.794 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 51.0 Cg_exo -40.68 135.47 2.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.243 2.629 . . . . 10.0 112.044 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.761 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 35.9 Cg_endo -63.52 137.15 58.21 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.827 2.351 . . . . 10.0 112.388 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.409 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 94.8 mt -61.01 118.33 34.62 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.069 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 25.4 Cg_endo -61.62 -22.18 73.84 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.053 2.502 . . . . 10.0 112.617 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.03 -14.55 59.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.046 -0.524 . . . . 10.0 111.2 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.407 HG13 ' HB ' ' B' ' 102' ' ' VAL . 0.2 OUTLIER -133.1 -138.63 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.282 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -154.66 49.23 0.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 10.0 110.085 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -149.55 147.93 28.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.445 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -74.28 159.38 32.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.718 0.294 . . . . 10.0 111.158 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.535 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -99.72 169.04 9.53 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.429 -179.426 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.673 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 34.2 tt0 -115.86 120.17 38.36 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.298 -0.26 . . . . 10.0 110.298 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.023 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -162.55 -65.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.127 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.468 ' HA ' ' OE1' ' A' ' 21' ' ' GLN . 0.0 OUTLIER 175.07 -57.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.957 -1.127 . . . . 10.0 107.957 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 114.695 -1.139 . . . . 10.0 109.191 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tmm? . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.692 0.282 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.03 134.52 45.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.373 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.43 120.19 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 121.208 0.528 . . . . 10.0 111.707 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.76 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 69.6 m-85 -109.84 114.71 28.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.199 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.78 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.7 160.95 32.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.843 0.354 . . . . 10.0 111.56 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -129.61 107.2 9.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.011 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.559 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.2 mm -81.91 102.4 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.2 ttt180 -101.18 103.41 14.45 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.408 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.3 ttp85 -88.66 71.26 8.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.622 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.3 t-80 68.02 -81.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.193 -0.912 . . . . 10.0 111.098 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -107.28 -16.32 14.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.903 0.382 . . . . 10.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 0.9 OUTLIER -95.09 97.69 10.11 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.102 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 4.3 m -97.24 115.66 28.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.886 0.374 . . . . 10.0 110.549 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.516 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 54.3 mt -106.92 118.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.105 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -77.93 120.8 23.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.78 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -114.05 121.97 45.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.091 0.472 . . . . 10.0 111.976 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.634 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.5 t70 -107.96 98.25 7.85 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.06 -1.089 . . . . 10.0 108.06 178.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.77 -167.75 1.63 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.324 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -126.22 160.61 29.81 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -60.81 -20.62 61.96 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 12.7 m -86.73 -7.91 57.86 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m -78.11 142.59 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.6 p -90.19 164.06 14.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.787 0.327 . . . . 10.0 110.794 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.4 t -63.26 -39.31 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.369 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -61.59 -32.27 72.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.22 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.96 -38.81 89.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.633 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.727 HD11 HD21 ' B' ' 57' ' ' LEU . 61.8 mt -60.68 -42.42 97.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.033 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -64.84 -35.41 81.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.967 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -66.79 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 77.7 mt -73.18 -46.3 51.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.7 t -61.52 -34.72 62.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.521 179.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.07 -37.38 71.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.864 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.22 -5.71 89.87 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.905 -0.664 . . . . 10.0 113.072 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -105.15 -49.09 9.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.985 0.421 . . . . 10.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.32 -8.54 54.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.412 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 79.0 mttt 56.92 46.48 19.5 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.377 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 1.0 OUTLIER -142.64 143.09 24.8 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.576 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 77.5 Cg_exo -51.84 133.56 45.69 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.438 2.758 . . . . 10.0 113.488 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.94 -16.08 32.63 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.033 2.489 . . . . 10.0 111.957 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.54 -29.05 70.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.434 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -96.09 3.12 53.56 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.946 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.98 132.74 35.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 111.207 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 73.0 mmt-85 -123.86 115.89 22.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.073 178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 83.4 mt -93.41 123.09 36.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.163 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -117.26 119.47 35.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.519 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.486 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.2 tttm -125.1 134.19 52.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 57.74 34.71 24.78 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.296 0.372 . . . . 10.0 110.623 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 65.97 16.14 10.35 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.682 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -123.89 159.76 28.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.825 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.1 tp -87.89 134.32 33.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' B' ' 46' ' ' LYS . 85.8 mt -80.71 152.2 28.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.14 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -92.96 118.47 31.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.143 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 16.3 m-20 -60.25 -26.96 66.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.66 3.74 85.03 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.738 -0.744 . . . . 10.0 113.118 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -108.23 164.99 11.83 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.152 0.501 . . . . 10.0 111.574 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.2 p -96.34 169.71 9.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.675 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.727 HD21 HD11 ' B' ' 27' ' ' LEU . 32.1 mt -62.37 -39.08 92.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.543 -0.298 . . . . 10.0 111.146 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.15 -39.28 94.27 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.031 -0.604 . . . . 10.0 112.594 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -75.02 -24.28 58.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 10.0 110.958 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 63.9 m -85.86 4.44 37.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.766 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.37 14.64 61.61 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.668 -0.777 . . . . 10.0 113.413 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.515 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 57.8 m-85 -87.4 67.23 9.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.968 0.413 . . . . 10.0 110.14 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -95.01 161.89 13.95 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 24.8 m -65.83 -7.63 17.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 10.0 111.56 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -74.71 -48.54 25.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.313 0.578 . . . . 10.0 109.578 178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.03 -40.5 18.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.453 -0.794 . . . . 10.0 109.971 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.76 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -95.46 100.41 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.55 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -115.39 159.42 38.37 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.707 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -58.38 -19.26 42.55 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.881 2.388 . . . . 10.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -116.41 8.25 14.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.061 179.363 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.457 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -153.14 84.51 4.41 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.597 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.561 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.7 Cg_exo -78.31 137.47 15.05 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.844 2.362 . . . . 10.0 111.33 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.12 115.97 9.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.3 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.18 123.32 21.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.441 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.559 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.6 t -122.41 135.58 62.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.49 135.14 12.95 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.684 -0.77 . . . . 10.0 111.695 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.3 tp -116.81 99.92 7.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.96 0.41 . . . . 10.0 111.552 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.87 125.28 37.4 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -106.46 125.36 50.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.699 0.285 . . . . 10.0 110.96 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -75.31 112.18 11.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.061 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.36 139.82 48.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.34 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -77.98 145.1 36.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.392 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 61.14 15.85 6.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.041 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.5 m -127.7 107.99 10.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.638 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -87.25 4.99 40.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.613 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.503 ' O ' HG13 ' B' ' 90' ' ' ILE . 32.7 tt0 -59.9 -28.71 67.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.419 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.57 68.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.02 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.3 mt -71.36 -28.0 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.895 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 19.1 m -80.99 -25.82 36.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.245 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.622 HG12 ' HB2' ' B' ' 10' ' ' HIS . 6.4 mt -91.36 -9.83 10.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.024 0.44 . . . . 10.0 110.817 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 40.4 tt0 -91.45 107.52 22.35 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.641 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 18.1 Cg_exo -68.59 -11.85 33.06 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 10.0 111.582 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -71.23 -38.22 71.98 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.211 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -100.74 -45.75 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.205 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.0 m -106.53 155.35 38.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.771 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 160.81 30.82 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.507 2.138 . . . . 10.0 111.632 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.83 139.85 70.59 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.413 2.075 . . . . 10.0 111.923 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -70.98 96.33 1.29 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.216 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.0 tp -130.46 122.84 20.07 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.95 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.6 Cg_exo -66.01 141.24 63.38 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.902 2.402 . . . . 10.0 111.896 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.79 -35.05 79.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.53 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.407 ' HB ' HG13 ' A' ' 29' ' ' VAL . 12.6 m -68.31 -23.38 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.154 0.502 . . . . 10.0 111.012 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.2 mmm -113.88 59.19 0.67 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.589 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 34.1 ttpt -138.33 -50.88 0.02 OUTLIER Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.565 -0.743 . . . . 10.0 112.269 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 12.5 Cg_exo -73.65 50.6 2.07 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.877 2.385 . . . . 10.0 112.199 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -124.02 160.01 28.6 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.851 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.91 175.5 9.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.894 0.378 . . . . 10.0 111.497 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.9 m -99.82 137.69 37.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.511 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.75 -133.44 2.33 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.432 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.57 -43.3 5.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.037 0.446 . . . . 10.0 111.285 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 15.0 m -81.57 161.23 23.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.271 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 135.59 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.58 0.13 3.55 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.668 0.605 . . . . 10.0 111.391 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.45 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 40.1 tt0 -79.39 115.83 19.26 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.936 0.398 . . . . 10.0 110.421 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -96.98 138.47 34.46 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.069 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.31 108.29 16.73 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.959 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.3 126.57 39.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.372 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.053 179.507 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.966 0.412 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 77.7 tttt -106.39 117.8 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.051 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.539 HD22 ' HE2' ' C' ' 44' ' ' PHE . 24.9 mt -98.44 123.96 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 20.6 mt -111.51 118.57 57.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -93.38 166.59 12.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.439 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -9.79 29.75 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -87.91 4.25 45.49 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.863 0.363 . . . . 10.0 110.652 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.91 23.89 73.49 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.563 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -96.98 128.23 43.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 10.0 110.659 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 13.3 mt-10 -101.08 118.39 36.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.387 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.415 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 90.7 m-85 -109.8 117.27 33.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.767 0.317 . . . . 10.0 111.048 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.516 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -100.22 113.42 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.72 136.54 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.47 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.634 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.8 tttt -59.59 128.61 37.86 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.27 -0.641 . . . . 10.0 109.27 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 25.1 ttt180 -56.38 -28.34 58.92 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -57.19 -51.97 67.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 10.0 110.196 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -73.63 -29.61 62.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.097 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -65.15 -33.48 76.11 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.073 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 68.5 mt -61.84 -47.46 84.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.231 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.58 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.1 m -66.01 -36.34 83.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.833 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 23.3 m -68.26 -17.93 64.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.441 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -86.55 -16.17 62.5 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.063 -0.815 . . . . 10.0 111.063 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.9 m -83.55 -28.55 28.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.351 0.596 . . . . 10.0 109.639 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.11 141.96 15.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -70.38 88.46 0.65 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.356 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.481 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.06 177.05 5.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.396 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.496 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 89.2 mmm -80.07 36.97 0.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.74 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 tp -68.15 -30.33 69.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.415 0.626 . . . . 10.0 109.368 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.63 15.93 10.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.286 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.91 -64.03 3.36 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.525 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.65 169.5 12.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.565 2.176 . . . . 10.0 111.926 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.96 -52.73 50.48 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.116 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -139.08 116.62 11.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.825 0.345 . . . . 10.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -84.84 93.22 8.45 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.18 165.91 23.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.986 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -59.98 -25.35 65.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.313 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.17 -37.9 88.84 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.5 mp0 -74.27 -30.54 62.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.046 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.69 -22.35 58.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.322 0.582 . . . . 10.0 109.74 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -83.63 -61.88 1.72 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.148 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 42.4 mt-10 -130.8 109.33 10.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.512 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 0.6 OUTLIER -90.7 119.98 38.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.856 -179.078 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -93.61 114.41 26.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.9 0.381 . . . . 10.0 110.689 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.631 ' HB3' HD12 ' C' ' 47' ' ' ILE . 71.7 m-85 -103.95 99.09 8.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.359 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -89.12 147.0 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.053 -0.522 . . . . 10.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 69.75 17.91 7.59 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.698 0.624 . . . . 10.0 111.21 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.631 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.3 mt -124.73 109.52 28.14 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.895 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.91 144.52 99.45 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.048 2.499 . . . . 10.0 112.02 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.4 p -62.12 -36.76 82.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.19 -55.35 32.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.811 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.487 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.7 m -66.27 -36.26 76.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.865 -0.334 . . . . 10.0 111.214 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -63.89 -36.45 83.96 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.329 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -62.37 -41.7 98.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.058 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -66.11 -37.64 86.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.171 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.487 HG23 ' O ' ' C' ' 51' ' ' VAL . 98.7 t -63.59 -44.72 98.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 61.5 m -61.25 -42.7 99.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.433 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.4 mtm -65.15 -37.78 88.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.474 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 86.2 t80 -65.15 -43.76 90.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.403 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.44 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.8 m-85 -61.48 -44.03 97.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.003 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 27.0 m -58.77 -43.31 90.37 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.943 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.417 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 32.8 t80 -65.13 -43.77 90.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.145 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -62.57 -40.4 96.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.293 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.58 HG22 ' HB ' ' C' ' 20' ' ' THR . 44.0 t -58.82 -50.89 77.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.447 . . . . 10.0 109.911 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -69.8 -38.78 76.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.353 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.586 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 44.1 t80 -57.87 -46.35 84.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 10.0 110.822 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.62 18.72 3.78 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.343 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 67' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 12.6 t30 -125.62 -49.5 1.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.868 0.366 . . . . 10.0 111.553 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.72 -31.24 0.39 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.982 0.42 . . . . 10.0 111.774 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.586 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 6.7 m -81.44 31.7 0.34 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.403 0.519 . . . . 10.0 112.403 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.45 -12.63 60.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.339 0.59 . . . . 10.0 110.215 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -77.16 -30.32 54.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.37 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.702 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.7 pt -84.25 165.0 40.98 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.702 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.0 Cg_endo -70.95 167.58 25.57 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.403 2.069 . . . . 10.0 112.872 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -66.4 165.19 14.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.209 -0.905 . . . . 10.0 109.607 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -46.16 126.41 7.3 Favored Pre-proline 0 C--O 1.233 0.223 0 O-C-N 123.56 0.538 . . . . 10.0 111.32 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -51.21 119.72 5.81 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.097 2.532 . . . . 10.0 112.598 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.792 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.8 pt -79.58 47.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.729 -0.668 . . . . 10.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -96.49 -55.87 0.2 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 11.3 Cg_exo -71.15 107.78 2.19 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.032 1.822 . . . . 10.0 111.88 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 1.8 mp0 -76.79 59.87 1.64 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.741 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.3 mm -120.78 -2.66 8.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.268 0.556 . . . . 10.0 110.462 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.472 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -67.7 -34.02 76.06 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.149 -0.344 . . . . 10.0 111.862 -179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 86' ' ' LEU . 28.4 tp -66.11 -35.56 80.82 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.279 0.561 . . . . 10.0 109.797 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.582 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 19.1 mp0 -63.17 -34.4 77.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.254 -0.885 . . . . 10.0 109.717 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 8' ' ' LEU . 82.0 mt -73.82 -31.87 63.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.925 179.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 83' ' ' LEU . 97.1 mt -67.24 -17.05 64.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.055 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.6 ttp -69.46 -13.96 62.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.18 -33.32 74.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.932 -0.396 . . . . 10.0 109.932 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.84 -67.84 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.288 0.847 . . . . 10.0 113.288 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -83.89 42.5 0.86 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 10.0 111.437 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 2.6 t80 . . . . . 0 C--O 1.246 0.873 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.727 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.448 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -57.83 -60.03 4.32 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.205 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.742 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.4 tp -62.91 -29.03 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 10.0 112.012 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.727 HE21 ' N ' ' A' ' 6' ' ' GLY . 0.2 OUTLIER -58.96 -33.37 70.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 10.0 111.125 179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -95.93 -37.79 10.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.454 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 93.1 mt -63.69 -45.9 87.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.425 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.07 -28.25 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 10.0 111.308 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.88 -33.09 75.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 10.0 110.373 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.91 -13.03 40.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.243 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.98 -35.49 23.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.708 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HA ' HG22 ' C' ' 77' ' ' ILE . 9.8 tp -159.62 122.44 3.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.371 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 11.1 mt -89.31 88.11 2.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -99.18 102.86 17.12 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.179 0.437 . . . . 10.0 112.179 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 4.3 Cg_endo -89.48 93.1 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.162 2.575 . . . . 10.0 110.261 178.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -157.2 177.49 11.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.462 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 45.3 mm-40 -87.36 152.38 22.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.96 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.868 HD11 HD23 ' C' ' 83' ' ' LEU . 49.2 mm -118.13 107.14 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.27 -179.108 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.817 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 27.9 tttp -117.68 144.32 34.09 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.721 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 24.4 Cg_exo -32.3 133.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 124.265 3.31 . . . . 10.0 113.742 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.831 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.3 Cg_endo -62.2 138.15 70.4 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 123.105 2.537 . . . . 10.0 112.701 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -72.76 124.79 91.16 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.404 179.45 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.63 -10.36 28.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.218 2.612 . . . . 10.0 112.912 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -36.84 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.861 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 30' ' ' ARG . 3.1 t -129.24 -103.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.399 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG2' HG12 ' A' ' 29' ' ' VAL . 2.0 ptp180 -178.33 63.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.899 0.48 . . . . 10.0 111.112 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -156.09 145.03 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.831 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.5 pp -72.05 149.5 44.81 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.12 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.3 m -84.67 137.7 33.1 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -97.28 80.85 2.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.108 0.48 . . . . 10.0 110.564 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.0 t70 -125.87 -75.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.601 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.85 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.468 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.666 -0.683 . . . . 10.0 109.396 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.433 ' HA ' ' OE1' ' B' ' 20' ' ' GLU . 12.1 mmm . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.666 0.27 . . . . 10.0 111.177 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.82 131.02 3.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.144 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.454 HG11 HD13 ' B' ' 57' ' ' LEU . 47.2 t -134.93 121.8 35.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.962 0.41 . . . . 10.0 111.004 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.92 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 34.4 m-85 -111.26 121.01 44.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.719 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.733 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -135.6 160.19 39.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.811 0.339 . . . . 10.0 111.366 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.635 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 37.3 mtm -126.45 108.42 11.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.043 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.432 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.3 mm -80.44 103.6 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -98.97 102.64 14.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.554 ' HB2' HD23 ' B' ' 77' ' ' LEU . 15.8 ttp85 -90.46 69.59 6.88 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.228 -1.397 . . . . 10.0 107.228 177.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.7 t-160 68.57 -77.05 0.05 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.888 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.441 ' HD2' ' CD2' ' C' ' 9' ' ' HIS . 74.1 mmtt -112.06 -20.9 11.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.892 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -90.5 101.0 13.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.773 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 3.0 m -100.48 117.19 34.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.949 0.404 . . . . 10.0 110.812 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.577 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 56.4 mt -107.27 116.75 51.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.02 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -76.82 118.32 19.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.733 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.4 m -110.31 117.92 34.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.122 0.487 . . . . 10.0 111.529 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 1.019 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -108.73 103.73 12.88 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.131 -1.063 . . . . 10.0 108.131 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -135.05 -159.66 0.98 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.902 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -129.73 167.91 17.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 31.8 mp0 -64.81 -23.55 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.909 0.385 . . . . 10.0 110.793 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -16.76 63.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.547 -0.751 . . . . 10.0 111.798 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.41 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 7.7 m -78.46 145.54 34.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.746 0.308 . . . . 10.0 110.725 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.7 p -98.39 163.81 12.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.311 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 53.8 t -60.6 -38.09 77.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 110.491 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -61.18 -31.8 71.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.515 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -72.38 -28.12 62.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.772 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.511 HD11 HD21 ' B' ' 57' ' ' LEU . 86.6 mt -65.9 -41.4 91.54 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -60.46 -36.65 78.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.95 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -63.71 -41.01 98.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.144 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -65.77 -47.04 87.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.022 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.32 -40.6 89.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.209 0.528 . . . . 10.0 110.234 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.58 -38.71 92.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.875 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.86 -15.01 66.34 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.735 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.4 mt -103.69 -50.07 9.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 10.0 111.48 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 65.9 mt -83.51 -20.94 33.01 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.635 0.605 . . . . 10.0 112.635 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt 57.77 53.49 7.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.213 0.53 . . . . 10.0 111.61 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 73.4 mtt-85 -139.9 154.51 70.72 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.636 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.48 121.72 6.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.55 2.834 . . . . 10.0 113.766 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.44 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 64.5 Cg_endo -74.28 -18.44 20.68 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.868 2.379 . . . . 10.0 112.645 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -70.49 -25.01 62.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.826 0.346 . . . . 10.0 111.846 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -95.68 3.31 54.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 80.4 mt-30 -84.06 102.53 12.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.783 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.771 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.1 mmt-85 -89.65 97.86 11.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.135 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 87.5 mt -82.11 111.29 18.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.31 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -110.25 115.62 30.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' B' ' 51' ' ' LEU . 45.9 tttm -124.39 137.22 54.48 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.231 -1.026 . . . . 10.0 108.231 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 61.71 26.4 16.06 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.253 0.346 . . . . 10.0 110.329 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 72.66 12.47 5.39 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.159 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -127.05 162.27 26.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.382 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.7 tp -82.35 133.64 35.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.587 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' B' ' 46' ' ' LYS . 74.5 mt -77.94 146.76 35.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.73 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HD2' ' B' ' 55' ' ' LYS . 34.7 t0 -94.49 122.26 36.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 10.0 111.592 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 9.1 m-20 -60.88 -26.79 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.218 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.47 11.98 59.98 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.508 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' B' ' 52' ' ' ASP . 39.8 mttp -126.12 153.86 43.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.005 0.431 . . . . 10.0 111.19 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.8 p -84.45 170.09 13.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.511 HD21 HD11 ' B' ' 27' ' ' LEU . 38.2 mt -61.08 -39.39 89.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.4 -0.363 . . . . 10.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.21 96.21 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.64 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -69.94 -19.14 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.858 0.361 . . . . 10.0 111.332 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.28 10.26 22.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.933 0.397 . . . . 10.0 111.475 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.82 51.49 5.87 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.654 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.542 ' HE1' ' HB3' ' B' ' 73' ' ' ALA . 9.1 m-85 -114.99 78.62 1.18 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.925 0.393 . . . . 10.0 110.486 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -92.21 168.09 11.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -11.41 57.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.14 0.495 . . . . 10.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -83.71 -40.63 18.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.124 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.1 -27.83 26.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.479 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.92 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -114.25 94.85 4.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 55.5 mtt180 -116.04 155.37 48.08 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.769 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.6 -13.39 35.01 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.162 1.908 . . . . 10.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.44 ' OE1' ' HD3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -104.51 -4.96 22.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.948 -1.024 . . . . 10.0 110.056 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.93 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -164.3 93.07 1.01 Allowed Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.965 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.635 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.1 Cg_exo -78.14 140.43 17.74 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.8 2.333 . . . . 10.0 110.914 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ALA . . . . . 0.542 ' HB3' ' HE1' ' B' ' 62' ' ' PHE . . . -66.61 113.52 4.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 -179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.43 122.97 20.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.813 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.432 ' HB ' HD13 ' B' ' 7' ' ' ILE . 53.9 t -120.23 132.61 69.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 108.655 -0.868 . . . . 10.0 108.655 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.86 131.25 10.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.244 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' B' ' 9' ' ' ARG . 46.4 tp -109.26 97.05 6.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.964 0.411 . . . . 10.0 111.04 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.771 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.78 105.55 17.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.136 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -88.89 105.63 17.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.133 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -77.41 116.93 18.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.318 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -125.06 148.58 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.207 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.85 130.1 42.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.383 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t0 61.9 27.76 16.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.534 0.683 . . . . 10.0 111.382 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 13.6 m -124.16 106.05 10.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.241 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -78.52 -9.63 59.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.859 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 44.6 tt0 -56.28 -38.42 71.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.948 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.62 74.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.916 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.14 -24.57 65.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.471 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 13.9 m -84.17 -21.19 31.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.913 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.5 mt -91.91 -34.45 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.108 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 73.8 tt0 -64.24 115.49 20.04 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.58 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.512 ' HA ' ' O ' ' B' ' 95' ' ' SER . 22.6 Cg_exo -66.87 -11.06 30.61 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.037 2.491 . . . . 10.0 112.15 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -72.8 -25.86 61.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.765 -0.458 . . . . 10.0 109.765 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.63 -51.4 2.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.597 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.512 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 41.9 m -96.55 139.51 21.69 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.396 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.76 166.38 29.03 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.673 2.249 . . . . 10.0 111.181 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.45 115.19 2.3 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.729 2.286 . . . . 10.0 112.281 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -70.31 99.76 1.6 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.931 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 tp -131.83 128.28 21.56 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.336 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.555 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 71.5 Cg_exo -52.06 124.91 15.82 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.034 2.49 . . . . 10.0 112.151 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.58 -38.79 85.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.459 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 m -67.14 -19.0 24.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.188 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.555 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 66.8 mmm -115.71 41.01 2.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.467 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 35.4 tttm -111.65 -53.13 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 8.1 Cg_exo -73.96 66.5 5.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.587 2.191 . . . . 10.0 112.237 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -134.37 173.98 11.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.711 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.44 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.2 t70 -87.18 179.84 6.57 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 9.5 m -108.79 148.33 30.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.262 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' GLY . . . . . 0.43 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -87.75 -150.16 18.82 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.26 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.6 -31.59 15.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.293 0.568 . . . . 10.0 110.458 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.93 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.3 m -96.09 163.78 12.97 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.092 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.18 140.55 54.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.18 -8.14 1.04 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.623 0.577 . . . . 10.0 111.73 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.43 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 37.9 tt0 -75.56 125.89 29.93 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -110.27 156.15 21.08 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.977 0.417 . . . . 10.0 111.143 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.44 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -123.15 103.3 8.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.045 179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.25 126.79 34.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.577 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 C--O 1.237 0.43 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.193 179.459 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.049 0.452 . . . . 10.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 80.2 tttt -109.71 122.58 47.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.575 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 41.1 mt -99.28 132.26 44.73 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.916 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' C' ' 41' ' ' GLU . 11.2 mt -114.51 119.64 62.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.721 0.296 . . . . 10.0 110.22 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 m -85.55 156.52 20.72 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.319 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.7 m -61.82 -25.13 67.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -9.22 58.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.845 0.355 . . . . 10.0 111.263 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.83 28.87 8.02 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.686 -0.768 . . . . 10.0 112.895 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 9' ' ' HIS . . . . . 0.441 ' CD2' ' HD2' ' B' ' 11' ' ' LYS . 8.7 m170 -101.61 145.76 28.62 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.785 -0.244 . . . . 10.0 110.346 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.447 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 21.8 mt-10 -114.74 130.76 56.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.358 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 78.7 m-85 -122.91 118.85 28.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.496 -0.32 . . . . 10.0 110.801 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -102.04 118.58 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 25.3 t -106.84 139.89 26.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 121.229 -0.188 . . . . 10.0 110.77 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 1.019 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 70.4 tttt -60.26 128.5 37.07 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -54.3 -32.85 57.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.983 0.364 . . . . 10.0 111.983 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.498 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 42.3 tt0 -58.34 -37.98 76.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.016 0.436 . . . . 10.0 110.937 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -86.08 -40.17 16.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.178 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.35 90.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.987 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 72.7 mt -59.65 -46.2 89.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.934 0.397 . . . . 10.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -67.81 -32.35 72.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.527 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 25.7 m -69.12 -34.78 75.59 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.1 -10.5 84.18 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.657 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 7.9 m -81.13 -21.49 39.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.92 -0.771 . . . . 10.0 108.92 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -81.28 154.69 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.247 -1.02 . . . . 10.0 108.247 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -73.53 82.59 1.49 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.992 0.425 . . . . 10.0 110.732 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -91.52 170.06 10.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.955 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.692 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 82.6 mmm -78.89 45.13 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.527 0.565 . . . . 10.0 112.527 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.87 -26.47 62.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.273 0.559 . . . . 10.0 109.554 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.76 6.05 37.01 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.346 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.03 -58.44 14.52 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.432 -0.804 . . . . 10.0 113.338 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.47 -175.48 1.58 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.264 1.976 . . . . 10.0 111.899 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.62 -58.71 5.68 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.69 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -137.23 118.32 14.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.69 0.281 . . . . 10.0 110.282 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -79.79 83.18 5.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.148 0.499 . . . . 10.0 110.049 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.94 158.57 34.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.197 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.9 -27.67 60.98 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.752 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -60.37 -45.24 94.22 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.542 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.3 tp10 -74.29 -28.91 61.41 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.523 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -67.48 -26.25 66.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 10.0 110.789 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -89.98 -57.63 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.687 ' HB3' HD11 ' C' ' 4' ' ' ILE . 19.4 mt-10 -119.44 93.22 4.0 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.791 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -80.54 108.53 14.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.125 -178.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 43' ' ' ASN . . . . . 0.54 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 27.2 t-20 -92.57 118.25 30.81 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.761 0.315 . . . . 10.0 110.246 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.586 ' HB3' HD12 ' C' ' 47' ' ' ILE . 91.7 m-85 -95.33 138.99 32.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 10.0 111.953 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 mmt85 -105.48 135.37 47.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.123 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 62.04 27.46 16.6 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.722 0.638 . . . . 10.0 111.796 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.586 HD12 ' HB3' ' C' ' 44' ' ' PHE . 81.6 mt -124.56 107.06 29.53 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-O 121.072 0.463 . . . . 10.0 111.02 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.445 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 16.5 Cg_exo -70.84 138.38 34.26 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.204 2.603 . . . . 10.0 111.913 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 49' ' ' SER . . . . . 0.437 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 0.9 OUTLIER -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.97 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -34.17 71.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.06 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.524 ' HB ' HD21 ' C' ' 85' ' ' LEU . 17.4 m -93.59 -27.89 4.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.676 -0.41 . . . . 10.0 110.586 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -67.39 -34.0 76.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.951 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.93 -40.27 92.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.052 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -65.49 -35.38 80.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.403 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.16 -42.98 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 47.1 m -62.86 -41.48 99.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.352 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 60.9 mtm -66.49 -37.14 84.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.614 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.581 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -64.02 -44.1 93.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.165 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.431 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.2 m-85 -61.88 -44.24 97.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.281 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 30.1 m -60.62 -42.54 97.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.836 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -65.19 -42.04 93.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.997 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 20.9 tptt -62.79 -42.62 99.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.523 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 59' ' ' PHE . 68.3 t -60.03 -46.21 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.605 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.4 mmt85 -72.4 -38.47 68.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.958 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.879 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 74.6 t80 -59.8 -55.34 35.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.134 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 51.94 1.83 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.989 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -170.14 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.309 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.77 -38.27 1.01 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.326 0.491 . . . . 10.0 112.326 -178.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.879 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.3 m -83.75 28.44 0.58 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.919 0.39 . . . . 10.0 111.78 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.48 -12.96 61.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.844 0.354 . . . . 10.0 111.0 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -82.74 -20.42 36.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.73 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.738 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.42 169.08 8.6 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.758 -0.201 . . . . 10.0 110.463 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.738 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 71.9 Cg_endo -77.98 173.32 14.17 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.272 1.982 . . . . 10.0 113.002 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.557 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 15.4 tp10 -70.12 177.69 3.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.692 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.557 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 5.2 t80 -53.94 127.35 53.46 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -54.4 120.26 7.73 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.76 2.307 . . . . 10.0 112.315 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.735 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.5 pt -76.16 55.93 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.396 0.617 . . . . 10.0 110.917 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.669 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.28 -56.69 0.11 Allowed Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.834 -0.621 . . . . 10.0 112.187 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.669 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.9 Cg_exo -68.19 121.01 7.97 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.691 1.594 . . . . 10.0 110.529 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -77.62 29.02 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 46.9 mm -116.71 96.71 4.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.121 -0.696 . . . . 10.0 109.121 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.14 -40.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.431 -0.804 . . . . 10.0 109.605 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.868 HD23 HD11 ' A' ' 22' ' ' ILE . 4.4 tp -67.56 -22.77 65.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.617 -0.882 . . . . 10.0 108.617 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.701 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 31.9 mp0 -64.83 -32.76 74.6 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.812 -1.085 . . . . 10.0 109.164 177.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.742 ' HB3' HD21 ' A' ' 8' ' ' LEU . 64.9 mt -80.44 -33.55 36.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.297 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.484 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.6 tt -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.104 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 87' ' ' MET . . . . . 0.456 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 36.2 ttp -63.61 -16.79 61.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.28 69.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.093 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.51 -68.65 0.17 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.053 0.76 . . . . 10.0 113.053 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -82.04 45.8 0.95 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 10.0 111.342 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.244 0.809 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 179.614 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 120.719 0.066 . . . . 10.0 112.962 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -68.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.324 0.861 . . . . 10.0 113.324 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.841 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.1 tp -61.6 -29.14 69.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.351 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.54 -31.41 46.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.116 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -105.07 -42.9 5.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.383 179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.547 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 82.5 mt -57.88 -41.44 82.51 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.26 70.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.729 0.3 . . . . 10.0 111.788 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 tp -67.75 -31.01 70.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 10.0 111.379 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.3 11.02 7.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.173 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.51 -52.6 1.6 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.011 0.434 . . . . 10.0 110.572 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' C' ' 77' ' ' ILE . 5.3 mt -131.56 94.36 3.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.341 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.425 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.9 mt -73.76 100.83 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.885 0.374 . . . . 10.0 110.544 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.701 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 83.6 tttt -103.69 101.8 26.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.59 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 83.7 Cg_endo -90.3 58.75 1.57 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.988 2.458 . . . . 10.0 111.91 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.701 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 30.4 mttm -110.02 -170.53 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.54 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.813 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 35.7 mm-40 -87.51 163.45 16.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.1 mm -112.61 144.84 19.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.669 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.034 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -172.33 138.85 0.97 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.006 -0.738 . . . . 10.0 109.006 179.309 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.742 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 71.4 Cg_exo -42.74 140.13 3.0 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.198 2.598 . . . . 10.0 112.423 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.64 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 44.8 Cg_endo -67.14 134.52 34.23 Favored 'Trans proline' 0 N--CA 1.465 -0.147 0 C-N-CA 122.846 2.364 . . . . 10.0 112.229 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.597 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.5 OUTLIER -75.97 119.24 76.32 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.367 179.182 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 18.3 Cg_endo -60.27 -15.28 33.96 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.286 2.657 . . . . 10.0 113.305 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -32.41 73.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.251 0.548 . . . . 10.0 109.638 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.843 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -128.42 -127.24 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.434 -0.803 . . . . 10.0 108.861 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -163.45 61.21 0.17 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.446 0.641 . . . . 10.0 110.223 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 12.1 tttm -157.03 150.69 24.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.086 -0.961 . . . . 10.0 108.815 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.64 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.9 pp -73.9 150.56 40.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.782 0.325 . . . . 10.0 110.751 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.5 m -88.06 169.51 11.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.824 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.813 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 17.5 tt0 -116.77 121.97 43.1 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.975 -0.379 . . . . 10.0 109.975 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.034 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.0 t70 -166.9 -75.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.252 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 170.96 -47.48 0.01 OUTLIER 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.322 -179.803 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.1 tmm? . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.866 0.365 . . . . 10.0 110.526 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.67 138.71 50.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.141 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.0 t -131.04 120.17 46.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.152 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.526 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.2 m-85 -109.48 120.71 43.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.472 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.757 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -131.69 159.33 38.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.8 0.333 . . . . 10.0 111.341 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -128.74 109.54 11.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.77 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 38.7 mm -82.05 105.19 11.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -104.87 104.58 14.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.07 0.767 . . . . 10.0 113.07 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.409 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 18.3 ttp85 -93.68 81.34 4.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.215 -1.402 . . . . 10.0 107.215 177.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.452 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.4 t-160 65.52 -85.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.353 -178.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -112.69 -13.34 13.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.137 0.494 . . . . 10.0 111.222 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.9 m -90.19 103.12 15.83 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -104.13 123.71 47.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.743 0.306 . . . . 10.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.596 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 66.1 mt -113.85 118.42 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.751 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' PHE . . . . . 0.433 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 68.2 t80 -79.54 121.54 25.36 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 178.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.757 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -114.73 122.28 45.93 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.245 0.545 . . . . 10.0 111.969 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.818 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -104.97 102.91 12.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.016 -1.105 . . . . 10.0 108.016 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.51 -166.33 1.62 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.952 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -134.9 161.25 35.76 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 6.8 mp0 -58.27 -28.99 65.45 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -10.97 60.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.1 m -85.67 147.1 26.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.388 -0.227 . . . . 10.0 110.388 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.4 p -91.67 164.14 13.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.747 0.308 . . . . 10.0 111.05 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.477 HG11 ' HB3' ' B' ' 51' ' ' LEU . 7.4 t -67.5 -32.67 58.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 10.0 110.179 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -62.09 -35.97 80.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.343 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.58 -35.41 79.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.883 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.64 HD11 HD21 ' B' ' 57' ' ' LEU . 73.7 mt -61.33 -40.82 95.64 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.051 0.453 . . . . 10.0 109.859 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -63.21 -35.36 80.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.082 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -69.46 -33.78 73.42 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.802 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' B' ' 27' ' ' LEU . 96.1 mt -67.62 -44.32 86.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 85.9 t -63.83 -36.1 75.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.32 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 30.5 tt0 -61.76 -37.28 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.815 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.36 -13.36 79.89 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.7 -0.762 . . . . 10.0 112.531 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -104.32 -56.09 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 10.0 111.73 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.72 -11.52 58.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.706 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 96.0 mttt 58.72 42.93 19.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.85 -0.614 . . . . 10.0 112.455 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' B' ' 37' ' ' ARG . 48.4 mtt-85 -129.71 141.47 41.93 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.172 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -53.67 130.97 41.57 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.145 2.563 . . . . 10.0 113.104 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.06 -13.65 34.18 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.98 2.453 . . . . 10.0 112.473 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.47 -37.33 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.413 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -96.22 9.56 40.65 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.42 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -90.08 126.49 35.8 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.775 0.321 . . . . 10.0 111.091 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 81.1 mmt-85 -119.7 113.15 20.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' B' ' 51' ' ' LEU . 94.9 mt -94.09 130.13 40.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.954 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -123.01 122.38 38.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.351 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.459 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.1 tttm -124.66 133.95 53.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.18 37.74 23.82 Favored 'General case' 0 C--O 1.234 0.27 0 O-C-N 123.458 0.474 . . . . 10.0 111.543 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 64.9 18.37 11.45 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.43 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -129.17 155.31 45.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.176 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 63.7 tp -76.09 138.51 40.84 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.924 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.477 ' HB3' HG11 ' B' ' 24' ' ' VAL . 33.9 mt -89.49 158.51 17.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.645 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' B' ' 53' ' ' ASP . 8.8 t70 -80.36 -160.85 0.32 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.465 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.467 ' H ' ' CG ' ' B' ' 52' ' ' ASP . 1.0 OUTLIER -135.05 -57.05 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.013 0.435 . . . . 10.0 110.322 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.79 -23.35 64.51 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.645 -0.707 . . . . 10.0 113.087 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -69.71 154.66 41.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.784 0.325 . . . . 10.0 110.581 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 40.9 p -86.97 166.79 14.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.238 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.64 HD21 HD11 ' B' ' 27' ' ' LEU . 36.5 mt -60.97 -40.81 94.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.833 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.81 -28.4 65.7 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.92 -0.657 . . . . 10.0 112.587 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -84.43 -11.58 55.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.803 0.335 . . . . 10.0 111.309 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 38.9 m -103.77 11.88 35.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.058 0.456 . . . . 10.0 111.915 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.04 8.11 69.43 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.337 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 63.2 m-85 -87.86 90.48 8.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.579 -0.365 . . . . 10.0 110.625 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -122.88 167.93 12.92 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.6 m -67.46 -4.43 11.32 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -89.52 -44.62 9.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.98 -33.94 26.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.248 0.547 . . . . 10.0 109.755 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.526 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -107.18 100.58 10.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.295 -0.866 . . . . 10.0 109.196 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -109.9 158.01 36.14 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.959 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.07 -18.5 63.82 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.439 2.093 . . . . 10.0 111.502 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 11.6 pt20 -107.56 4.69 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.362 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.568 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -163.62 86.97 1.24 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.782 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.572 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.4 Cg_exo -76.27 146.05 27.89 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.829 2.353 . . . . 10.0 111.332 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 117.01 15.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.109 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.3 m -72.84 126.14 29.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.168 0.509 . . . . 10.0 111.656 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.7 t -123.2 133.19 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.01 134.49 12.67 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.695 -0.764 . . . . 10.0 111.759 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.43 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 48.2 tp -110.88 101.75 10.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.888 0.375 . . . . 10.0 111.167 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.08 101.27 12.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -83.96 113.92 21.33 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.714 -0.476 . . . . 10.0 109.714 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -72.3 94.49 1.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.499 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -111.77 120.42 41.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.955 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.03 144.17 55.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.863 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.08 -5.05 2.02 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.737 0.648 . . . . 10.0 111.985 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m -111.98 104.72 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.012 0.434 . . . . 10.0 110.2 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -76.52 -7.92 56.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.87 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.46 ' O ' HG13 ' B' ' 90' ' ' ILE . 47.9 tt0 -56.97 -32.96 66.6 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.025 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.08 74.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.852 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.74 -29.68 68.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.665 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 21.3 m -78.9 -21.62 47.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.398 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.46 HG13 ' O ' ' B' ' 86' ' ' GLU . 27.1 mt -89.22 -18.61 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.25 0.548 . . . . 10.0 109.927 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.665 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 37.3 tt0 -80.68 111.93 27.31 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.203 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.632 ' HA ' ' O ' ' B' ' 95' ' ' SER . 67.9 Cg_endo -75.48 10.82 1.74 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.935 2.424 . . . . 10.0 112.111 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.665 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 45.2 t80 -91.78 -31.88 15.59 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 13.2 m -116.04 -16.36 11.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.323 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.632 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.1 m -128.28 147.26 62.89 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.249 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -73.78 156.77 48.44 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.444 2.096 . . . . 10.0 111.65 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.1 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.548 2.165 . . . . 10.0 111.706 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -59.23 114.98 2.9 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.433 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 22.3 tp -138.92 129.69 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.613 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.6 Cg_exo -60.65 130.32 32.88 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.768 2.312 . . . . 10.0 111.357 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.08 -35.46 80.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.95 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.843 ' HB ' HG13 ' A' ' 29' ' ' VAL . 22.3 m -67.97 -17.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.602 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 90.7 mmm -114.2 13.29 17.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.887 0.375 . . . . 10.0 110.746 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -82.12 -50.04 0.85 Allowed Pre-proline 0 CA--C 1.541 0.61 0 N-CA-C 113.198 0.814 . . . . 10.0 113.198 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -76.92 61.47 7.12 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.128 1.885 . . . . 10.0 112.447 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 59.2 mt-30 -130.55 150.53 51.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.536 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.429 ' H ' HE22 ' B' ' 118' ' ' GLN . 0.2 OUTLIER -77.87 158.32 29.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.441 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 37.9 m -73.16 138.6 45.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.374 -0.375 . . . . 10.0 110.407 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.72 -118.07 2.27 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.919 -0.658 . . . . 10.0 112.467 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -114.97 -46.29 2.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.986 0.422 . . . . 10.0 111.059 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 17.5 m -70.87 165.93 22.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.234 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ALA . . . . . 0.568 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.79 120.12 13.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.197 -0.456 . . . . 10.0 109.799 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.2 t30 68.81 31.09 4.54 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.735 0.647 . . . . 10.0 111.014 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -87.1 135.64 33.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.098 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -114.85 127.24 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.036 0.446 . . . . 10.0 111.38 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -100.91 115.32 30.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.539 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.489 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 1.8 t -73.29 118.08 18.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.415 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.429 HE22 ' H ' ' B' ' 107' ' ' ASP . 1.6 mp0 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.778 0.323 . . . . 10.0 110.929 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' C' ' 41' ' ' GLU . 32.9 ttpt -112.44 117.5 32.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.886 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.7 mt -89.21 135.57 33.5 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.433 HD11 ' HB3' ' C' ' 41' ' ' GLU . 35.9 mt -116.5 121.31 67.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 120.845 0.355 . . . . 10.0 110.64 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.85 165.85 13.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.117 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 14.4 m -64.24 -26.6 68.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.688 0.28 . . . . 10.0 111.646 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 7' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' C' ' 48' ' ' PRO . 14.2 m-20 -75.4 -3.21 32.43 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.149 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.95 10.56 66.44 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.122 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 9' ' ' HIS . . . . . 0.452 ' HB2' ' HB3' ' C' ' 49' ' ' SER . 0.2 OUTLIER -79.29 139.9 37.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.833 0.349 . . . . 10.0 110.561 179.863 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.7 mt-10 -111.79 133.78 53.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.679 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.448 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 85.8 m-85 -124.81 111.03 15.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.866 0.365 . . . . 10.0 111.687 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 11.2 mm -93.31 115.77 32.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 15.9 t -102.06 142.09 17.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.502 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.818 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 67.5 tttt -62.21 130.89 47.48 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.756 -0.461 . . . . 10.0 109.756 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 49.0 ttt180 -48.17 -42.26 29.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 112.176 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.411 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 48.5 tt0 -56.54 -49.19 75.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.965 0.412 . . . . 10.0 111.385 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -68.91 -36.17 77.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.951 0.405 . . . . 10.0 110.397 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.5 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.365 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 88.8 mt -60.6 -47.96 83.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.03 0.443 . . . . 10.0 110.832 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.566 ' HB ' HG22 ' C' ' 63' ' ' VAL . 2.2 m -62.85 -45.86 90.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.54 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 15.7 m -65.77 -24.37 66.93 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.056 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.78 -6.55 86.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.042 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 41.2 m -88.05 -28.19 21.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.287 0.565 . . . . 10.0 109.855 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -78.11 150.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.241 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.42 96.9 0.26 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.161 0.505 . . . . 10.0 110.652 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -103.67 176.21 5.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.019 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.631 ' SD ' ' HA3' ' C' ' 30' ' ' GLY . 1.1 tmm? -83.79 31.43 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.57 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.91 -29.84 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.386 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.8 p -90.57 -0.52 57.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.341 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 30' ' ' GLY . . . . . 0.631 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . -70.39 -56.02 8.15 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-N 115.65 -0.705 . . . . 10.0 114.576 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 31' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 25.0 Cg_endo -60.72 -13.02 24.01 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.988 2.459 . . . . 10.0 114.002 -179.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 124.85 -112.05 1.67 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.766 -0.73 . . . . 10.0 111.961 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -100.22 109.88 22.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.94 0.4 . . . . 10.0 110.038 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -86.55 103.84 15.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.818 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.37 167.29 9.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.408 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -52.77 -27.16 16.68 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -57.93 -33.75 69.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.04 0.448 . . . . 10.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -97.77 -24.92 15.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.264 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -64.69 -33.78 76.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.56 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -70.32 -52.54 22.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.176 0.512 . . . . 10.0 109.93 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' C' ' 2' ' ' LYS . 52.3 mt-10 -133.9 100.57 4.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.406 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 t -80.38 108.22 13.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.19 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -89.44 124.05 34.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.15 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.595 ' HB3' HD12 ' C' ' 47' ' ' ILE . 82.6 m-85 -104.77 128.62 52.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.688 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 45' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' C' ' 45' ' ' ARG . 8.1 mmt180 -101.48 140.69 35.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.006 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 60.11 31.45 20.57 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.304 0.573 . . . . 10.0 111.545 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.595 HD12 ' HB3' ' C' ' 44' ' ' PHE . 92.2 mt -131.21 110.79 15.36 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.499 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.535 ' HA ' ' OD2' ' C' ' 7' ' ' ASP . 17.8 Cg_exo -68.88 149.49 72.47 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 123.08 2.52 . . . . 10.0 111.925 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 49' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 1.8 p -65.6 -31.71 72.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.749 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -56.27 -54.4 45.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.631 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.58 -33.61 57.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.767 0.318 . . . . 10.0 111.112 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -64.81 -32.97 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.884 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 56.2 m -59.98 -40.63 89.81 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.806 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -68.01 -35.1 77.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.382 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 44.6 t -66.41 -43.8 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.046 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.418 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 69.9 mtm -67.04 -36.45 82.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.229 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.547 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 83.6 t80 -63.83 -42.61 97.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 7.1 m-85 -60.79 -46.21 91.37 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.622 178.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -58.13 -43.31 87.19 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.451 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 26.5 t80 -66.41 -45.53 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.473 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 tptt -62.5 -40.89 98.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.419 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.566 HG22 ' HB ' ' C' ' 20' ' ' THR . 41.5 t -58.45 -44.75 89.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.161 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 64' ' ' ARG . 12.2 mmt85 -74.37 -43.74 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.597 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.523 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 47.1 t80 -54.45 -43.47 71.65 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.905 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.93 14.71 13.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.082 0.468 . . . . 10.0 111.808 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -123.44 -62.28 1.33 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.94 0.348 . . . . 10.0 111.94 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 4.7 m -148.83 38.58 0.83 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.092 0.472 . . . . 10.0 110.711 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.523 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 19.7 m -147.75 36.0 0.86 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.17 0.51 . . . . 10.0 110.57 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.07 0.93 55.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.435 0.636 . . . . 10.0 110.108 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -75.91 -29.58 58.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.609 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 pt -94.9 159.53 33.0 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.681 -0.691 . . . . 10.0 109.247 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.81 -175.6 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.452 2.101 . . . . 10.0 112.509 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 12.0 tp10 -68.76 175.91 3.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.248 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.445 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 32.5 t80 -52.4 130.59 43.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.508 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.31 116.34 2.77 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.099 2.532 . . . . 10.0 111.813 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.78 ' HA ' HD23 ' A' ' 16' ' ' LEU . 10.2 mt -78.06 72.2 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.395 0.617 . . . . 10.0 111.272 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -120.4 -59.65 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.287 -0.869 . . . . 10.0 111.419 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.569 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 72.3 Cg_endo -77.71 102.78 1.63 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.597 1.531 . . . . 10.0 111.28 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.51 69.89 2.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.968 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -119.15 10.62 6.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.426 0.631 . . . . 10.0 110.08 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.702 ' HB2' ' HB2' ' A' ' 16' ' ' LEU . . . -73.35 -35.51 65.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.15 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.545 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 19.7 tp -66.0 -34.96 79.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.416 ' HA ' HD23 ' A' ' 32' ' ' LEU . 19.5 mp0 -64.13 -33.7 76.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.592 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.841 ' HB3' HD21 ' A' ' 8' ' ' LEU . 90.1 mt -77.2 -34.15 56.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.715 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.2 -12.13 61.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.768 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 47.7 ttp -62.71 -17.42 60.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 10.0 111.465 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.7 -9.75 58.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.781 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.91 -80.62 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 O-C-N 123.826 0.704 . . . . 10.0 112.421 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -101.8 83.7 2.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.522 0.677 . . . . 10.0 111.84 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.317 -0.843 0 N-CA-C 107.626 -1.25 . . . . 10.0 107.626 178.558 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.455 ' HA2' ' OE1' ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 112.779 -0.128 . . . . 10.0 112.779 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -67.78 -59.66 3.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.769 0.285 . . . . 10.0 111.414 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 15.5 tp -63.85 -24.05 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.053 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.455 ' OE1' ' HA2' ' A' ' 6' ' ' GLY . 60.4 mt-30 -54.81 -46.31 74.51 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.007 0.432 . . . . 10.0 110.399 178.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -88.97 -33.66 17.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.504 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 63.7 mt -59.66 -42.54 93.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.76 -40.52 79.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.899 0.38 . . . . 10.0 110.626 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.4 tp -66.72 -32.29 73.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.268 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.75 -3.43 56.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.607 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.3 -34.01 9.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.068 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.656 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.8 OUTLIER -161.75 118.19 2.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.015 179.667 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 4.4 mp -81.8 94.13 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 178.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 22.1 tttt -102.04 104.72 38.03 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 18.5 Cg_endo -93.81 68.95 0.41 Allowed 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.336 2.691 . . . . 10.0 110.214 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -120.93 -175.66 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.129 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -90.62 155.43 18.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.512 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.7 mm -118.3 126.95 75.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.058 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -145.66 141.45 16.86 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.508 -0.923 . . . . 10.0 108.508 179.339 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.436 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 29.5 Cg_exo -34.07 129.04 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.879 3.053 . . . . 10.0 113.143 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.744 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.3 Cg_endo -57.01 134.62 65.74 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.21 2.607 . . . . 10.0 112.566 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.482 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -73.64 125.96 90.11 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.034 179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -68.91 -12.22 33.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.95 2.433 . . . . 10.0 112.179 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -36.84 84.83 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.849 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -126.58 -114.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.13 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.432 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.4 ptp180 -168.44 53.64 0.05 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.085 0.469 . . . . 10.0 110.958 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.7 tttm -151.17 152.01 32.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.622 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.744 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -73.96 150.94 40.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.719 0.295 . . . . 10.0 110.708 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.602 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.2 m -92.9 169.58 10.34 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.343 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.402 ' H ' HG22 ' A' ' 33' ' ' THR . 19.0 mt-10 -120.12 123.4 43.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 10.0 110.408 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.981 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.5 OUTLIER -163.84 -70.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.666 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.0 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.545 -0.909 . . . . 10.0 108.545 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.125 -0.943 . . . . 10.0 109.09 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.777 0.322 . . . . 10.0 111.259 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -107.98 133.91 51.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 10.0 111.776 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 86.8 t -122.48 116.47 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.422 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 47.1 m-85 -102.82 118.27 36.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.545 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.715 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -129.31 158.47 39.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.919 0.39 . . . . 10.0 111.501 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 2.0 mtm -127.49 108.08 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.5 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.568 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -81.07 113.43 20.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -109.97 107.03 16.79 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.721 0.637 . . . . 10.0 112.721 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.573 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 25.7 ttp85 -96.97 74.29 2.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 177.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.64 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.7 t-160 68.31 -82.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.267 -177.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -115.61 -9.37 12.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.963 0.411 . . . . 10.0 110.928 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 7.2 m -93.15 98.66 11.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.82 128.73 44.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.694 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.602 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 69.3 mt -123.42 118.54 54.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.79 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -79.05 124.03 27.89 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.715 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -117.72 125.19 50.2 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.144 0.497 . . . . 10.0 111.707 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.419 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.2 t70 -108.73 99.68 9.01 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.01 -164.26 1.1 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.495 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm -130.22 165.36 22.56 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.422 ' O ' ' HB ' ' B' ' 56' ' ' THR . 25.0 mp0 -62.54 -29.53 70.63 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 57.7 m -78.43 -7.62 57.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 15.3 m -76.85 130.27 37.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 36.6 p -82.9 162.34 21.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.72 0.295 . . . . 10.0 110.769 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.824 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 78.1 t -63.94 -32.39 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.91 0.386 . . . . 10.0 110.451 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.38 -32.84 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.209 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.56 -33.51 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.435 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.731 HD11 HD21 ' B' ' 57' ' ' LEU . 91.9 mt -61.63 -46.0 91.68 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -61.82 -35.5 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.453 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.3 mtp180 -63.24 -38.21 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 10.0 109.998 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.1 -45.21 80.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.791 -0.641 . . . . 10.0 110.065 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.86 -38.57 82.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.419 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.834 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 3.8 tm-20 -58.93 -37.89 77.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.538 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.51 1.13 83.46 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.966 -0.561 . . . . 10.0 113.028 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 98.9 mt -113.52 -55.13 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.859 0.361 . . . . 10.0 110.772 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.09 -12.32 57.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.543 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt 58.48 49.98 9.92 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.91 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' B' ' 37' ' ' ARG . 57.1 mtt-85 -138.94 143.67 38.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.166 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.31 124.26 11.54 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.355 2.703 . . . . 10.0 113.069 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.834 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.2 Cg_endo -72.52 -16.52 27.21 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.804 2.336 . . . . 10.0 111.156 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.42 -29.11 69.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.011 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -98.29 5.49 48.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.893 0.378 . . . . 10.0 111.437 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -88.37 133.21 34.15 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.519 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.413 ' HD3' HH11 ' B' ' 43' ' ' ARG . 49.3 mmt-85 -119.65 114.88 22.87 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.53 120.88 37.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.618 -0.265 . . . . 10.0 110.382 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 83.6 m-85 -117.29 130.41 56.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.509 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 43.5 tttm -135.06 133.97 39.88 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 62.83 29.73 16.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.397 0.436 . . . . 10.0 110.57 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 72.23 6.17 5.47 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.309 -0.859 . . . . 10.0 111.852 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -120.77 161.77 20.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.1 tp -77.85 145.04 36.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.844 0.354 . . . . 10.0 111.319 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 34.9 mt -87.69 151.43 22.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.932 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -97.07 108.51 21.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.124 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.824 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.5 m-20 -51.06 -44.34 61.14 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 113.337 0.865 . . . . 10.0 113.337 -178.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -70.58 -7.16 60.56 Favored Glycine 0 CA--C 1.518 0.245 0 CA-C-N 116.13 -0.486 . . . . 10.0 114.226 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -102.6 162.18 13.13 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 117.107 0.453 . . . . 10.0 111.106 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 38.2 p -90.73 167.23 12.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.081 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.731 HD21 HD11 ' B' ' 27' ' ' LEU . 33.7 mt -59.93 -40.95 90.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.621 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.54 -37.23 88.21 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.055 -0.593 . . . . 10.0 112.201 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.96 -9.85 59.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.647 0.26 . . . . 10.0 111.512 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.6 m -102.71 8.66 39.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.987 0.422 . . . . 10.0 111.036 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.95 65.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.29 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.509 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 31.2 m-85 -87.08 76.79 9.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.94 0.4 . . . . 10.0 110.334 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.23 155.56 17.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.165 -0.471 . . . . 10.0 109.762 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 5.1 m -66.08 -11.97 52.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 10.0 111.376 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -75.76 -28.36 58.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.018 0.437 . . . . 10.0 110.465 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.25 -48.49 4.37 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -89.08 82.02 6.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.204 -0.907 . . . . 10.0 109.307 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.425 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 53.8 mtt180 -94.4 158.88 34.97 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.963 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 21.5 Cg_endo -62.95 -16.08 51.8 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.537 2.158 . . . . 10.0 111.925 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -105.69 2.92 28.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.411 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.83 82.98 2.01 Favored Pre-proline 0 C--O 1.233 0.235 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.878 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.41 132.57 25.93 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.712 2.275 . . . . 10.0 111.473 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.54 119.53 8.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.784 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.93 124.45 26.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.928 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.568 ' HB ' HD13 ' B' ' 7' ' ' ILE . 25.5 t -123.0 130.89 74.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.53 131.19 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.709 -0.758 . . . . 10.0 111.924 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.4 tp -113.9 110.75 20.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.422 . . . . 10.0 111.363 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -106.79 124.38 49.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.683 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -105.41 114.08 28.04 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 -71.64 113.53 8.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.031 0.443 . . . . 10.0 111.243 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.563 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -127.73 130.1 48.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.563 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -59.95 134.9 57.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.409 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.7 t70 71.27 -10.44 0.79 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.336 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.563 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 5.0 m -100.03 100.39 11.26 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.167 0.508 . . . . 10.0 110.276 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -77.21 1.13 19.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.7 -0.682 . . . . 10.0 112.28 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.29 -33.01 68.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.943 0.401 . . . . 10.0 110.27 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.14 82.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.238 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 91.0 mt -75.32 -7.09 53.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.567 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 18.6 m -96.85 -27.88 14.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.061 0.458 . . . . 10.0 110.344 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.2 mt -88.07 -31.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.481 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.417 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 39.1 tt0 -64.27 114.65 14.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.573 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.606 ' HA ' ' O ' ' B' ' 95' ' ' SER . 31.3 Cg_exo -63.3 -22.37 72.1 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.091 2.527 . . . . 10.0 111.827 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -67.95 -26.75 66.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.267 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -106.57 -40.0 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.881 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.606 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 74.1 m -128.82 136.16 28.72 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.539 0.209 . . . . 10.0 110.941 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.43 155.38 62.7 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.709 2.273 . . . . 10.0 111.812 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.19 133.32 41.43 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.107 2.538 . . . . 10.0 112.591 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.57 104.45 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.856 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 33.4 tp -131.19 124.21 20.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.221 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.8 Cg_exo -61.55 138.08 73.39 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.812 2.341 . . . . 10.0 111.923 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.11 -38.74 87.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.003 0.43 . . . . 10.0 111.309 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 29' ' ' VAL . 8.8 m -65.25 -18.23 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.241 0.543 . . . . 10.0 111.049 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.544 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 92.7 mmm -113.81 44.34 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.699 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 70.1 tttt -120.29 -51.26 0.04 OUTLIER Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.631 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.699 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 71.6 Cg_endo -75.42 55.26 4.11 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.223 1.949 . . . . 10.0 112.48 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.544 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.0 mt-30 -127.25 148.78 50.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.244 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -74.77 160.11 31.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 17.8 m -90.31 136.49 33.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.478 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.98 -135.05 2.34 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.187 -0.53 . . . . 10.0 113.262 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.62 -53.08 4.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.861 0.363 . . . . 10.0 111.376 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.884 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 23.7 m -70.64 159.81 33.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.398 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.42 127.12 30.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.989 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 t30 71.95 17.79 5.15 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.806 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.801 ' HG3' ' HB2' ' B' ' 111' ' ' SER . 0.5 OUTLIER -76.41 120.12 21.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -100.32 124.28 45.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.072 0.463 . . . . 10.0 111.258 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.59 97.1 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.47 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -60.86 128.29 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.303 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.974 179.88 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.234 0.244 0 CA-C-O 120.902 0.382 . . . . 10.0 110.828 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.797 ' HB3' ' HG2' ' C' ' 41' ' ' GLU . 5.3 ttpp -105.29 107.57 18.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.742 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 43.7 mt -91.33 113.64 25.96 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 5.5 mt -102.89 122.91 55.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.601 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.0 p -94.38 167.66 11.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -9.37 29.18 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.099 0.407 . . . . 10.0 112.099 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -86.61 -4.83 59.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.134 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.99 17.57 69.55 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.253 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.45 126.17 39.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 33.3 mt-10 -94.95 134.31 37.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.717 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 99.2 m-85 -123.4 104.89 9.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.77 0.319 . . . . 10.0 111.106 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.627 HD11 ' HD3' ' C' ' 2' ' ' LYS . 24.4 mm -88.69 115.75 29.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.403 -0.591 . . . . 10.0 109.403 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 41.8 t -105.86 127.78 60.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.622 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.419 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 77.9 tttt -54.99 129.4 37.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.29 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.476 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 32.4 ttt-85 -57.45 -30.86 65.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 10.0 112.038 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.16 -43.15 73.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.052 0.453 . . . . 10.0 110.644 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -81.33 -41.74 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.614 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ALA . . . . . 0.476 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -56.26 -33.78 65.79 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.733 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 50.9 mt -59.35 -44.93 92.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.85 0.357 . . . . 10.0 110.379 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.571 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.2 m -65.25 -46.42 80.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.417 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -37.43 86.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.924 0.392 . . . . 10.0 110.524 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.47 -17.77 74.82 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 116.064 -0.516 . . . . 10.0 112.09 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -80.65 -25.93 37.99 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 41.3 mt -79.41 154.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.413 -0.812 . . . . 10.0 108.931 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -71.8 87.64 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.006 0.432 . . . . 10.0 111.319 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.49 179.69 5.45 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.316 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.29 36.02 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.986 0.422 . . . . 10.0 111.48 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 9.9 tp -66.98 -31.71 72.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.326 0.584 . . . . 10.0 109.845 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 9.72 24.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.348 -0.842 . . . . 10.0 110.589 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.61 -64.47 3.69 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.877 -0.602 . . . . 10.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.61 177.11 7.22 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.694 2.262 . . . . 10.0 111.477 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.19 -77.6 0.27 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.969 -0.634 . . . . 10.0 112.215 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -117.21 116.88 28.14 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 10.0 110.521 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -95.3 89.87 5.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.82 164.43 26.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.198 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.8 -26.52 58.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.023 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -59.11 -52.76 64.34 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.463 ' O ' HG22 ' C' ' 42' ' ' VAL . 4.7 mp0 -72.63 -20.28 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.319 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 7.1 m -71.76 -29.6 64.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 10.0 110.69 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -93.03 -33.46 14.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.732 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.797 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 30.8 mt-10 -135.5 98.81 4.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.04 0.447 . . . . 10.0 110.301 179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.463 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.1 t -90.38 132.4 35.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.314 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -106.44 115.15 29.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.478 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.514 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.2 m-85 -104.1 112.88 26.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.511 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -102.86 148.19 25.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.15 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 70.13 14.59 7.69 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.687 0.617 . . . . 10.0 110.725 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.514 HD12 ' HB3' ' C' ' 44' ' ' PHE . 69.5 mt -125.19 108.27 27.41 Favored Pre-proline 0 N--CA 1.455 -0.203 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.38 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 32.0 Cg_exo -61.24 150.75 83.19 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.122 2.548 . . . . 10.0 112.384 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.2 p -61.46 -39.81 92.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 50' ' ' HIS . . . . . 0.413 ' CE1' ' HG3' ' B' ' 103' ' ' MET . 59.6 m80 -52.86 -56.52 15.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 10.0 112.66 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.478 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.4 m -65.2 -35.9 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.929 -0.308 . . . . 10.0 111.255 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -66.0 -35.21 79.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -61.19 -43.32 99.07 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.37 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -65.92 -35.85 81.77 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.218 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -64.12 -46.51 93.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.539 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.8 -42.52 99.11 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.624 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.53 -37.8 83.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.664 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.8 t80 -63.73 -44.03 94.76 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.995 -0.372 . . . . 10.0 109.995 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.6 m-85 -62.9 -44.21 96.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.087 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 58.6 m -57.83 -45.02 86.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.321 0.581 . . . . 10.0 109.783 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -65.56 -44.84 85.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.072 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -60.49 -40.64 92.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.296 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.571 HG22 ' HB ' ' C' ' 20' ' ' THR . 38.2 t -58.0 -48.48 84.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.458 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -74.01 -39.01 63.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.242 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.488 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 63.0 t80 -58.01 -45.57 86.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.416 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.41 23.95 2.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.131 0.491 . . . . 10.0 110.667 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -128.86 -62.41 1.01 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.57 -25.52 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.488 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.4 m -83.61 34.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.275 0.472 . . . . 10.0 112.275 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -6.5 59.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.567 0.698 . . . . 10.0 109.658 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -65.87 -26.48 67.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.738 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.632 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 23.0 pt -102.77 164.72 15.02 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.639 . . . . 10.0 109.437 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 74.0 Cg_endo -74.8 -170.85 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.458 2.105 . . . . 10.0 112.717 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -72.09 165.88 23.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.655 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -48.66 128.15 13.77 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 123.463 0.477 . . . . 10.0 111.011 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -50.14 121.89 8.34 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 123.104 2.536 . . . . 10.0 112.586 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.656 HG22 ' HA ' ' A' ' 16' ' ' LEU . 19.7 pt -79.04 52.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.669 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.518 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -99.34 -56.47 0.16 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.182 -0.463 . . . . 10.0 112.214 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.518 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 57.6 Cg_endo -70.21 117.4 5.09 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.616 1.544 . . . . 10.0 111.022 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 5.6 pt-20 -73.67 -2.61 23.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 39.7 mm -81.62 72.73 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.594 0.711 . . . . 10.0 110.604 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -137.89 -38.23 0.58 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.218 -0.901 . . . . 10.0 109.424 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.404 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.0 tp -67.97 -24.73 65.19 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.945 -0.761 . . . . 10.0 108.945 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.507 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 23.8 mp0 -62.98 -31.76 72.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.699 178.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.663 ' HB3' HD21 ' A' ' 8' ' ' LEU . 54.6 mt -77.66 -32.4 53.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.649 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -22.09 63.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.386 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.1 ttp -66.6 -19.71 65.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.332 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.68 -34.28 77.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.986 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.39 -56.97 0.5 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.959 0.787 . . . . 10.0 112.54 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -82.49 41.31 0.7 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.144 0.497 . . . . 10.0 110.592 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.241 0.647 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.641 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 112.475 -0.25 . . . . 10.0 112.475 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -68.97 -65.22 0.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.12 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.649 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.2 tp -61.31 -30.96 70.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.022 -178.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.641 HE21 ' N ' ' A' ' 6' ' ' GLY . 3.2 tt0 -54.73 -29.7 54.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.944 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -105.09 -37.32 6.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.587 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.596 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 80.6 mt -64.06 -44.6 91.96 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.12 -30.32 66.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 10.0 111.298 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.8 tp -66.27 -35.69 81.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.163 0.506 . . . . 10.0 110.254 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.28 -2.43 52.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.002 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -100.99 -23.2 14.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.546 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 12.3 tp -169.46 109.77 0.44 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.099 -0.5 . . . . 10.0 111.075 179.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.8 mt -82.92 83.69 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.566 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 21.5 tttt -92.35 111.37 50.15 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.394 -179.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -91.97 38.82 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.12 2.547 . . . . 10.0 112.554 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 45.5 mttm -93.48 166.13 12.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.772 0.32 . . . . 10.0 110.844 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -82.93 156.54 23.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -106.67 143.7 17.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.287 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.021 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -157.31 140.77 11.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.835 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.537 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 27.7 Cg_exo -36.08 131.52 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.802 3.001 . . . . 10.0 113.052 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.642 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.7 Cg_endo -57.18 144.05 91.56 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.432 2.755 . . . . 10.0 113.25 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mt -75.41 122.02 86.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.896 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.81 -23.28 75.89 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 123.037 2.492 . . . . 10.0 112.897 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -31.18 72.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.151 0.5 . . . . 10.0 110.47 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.484 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 m -128.46 -139.33 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.227 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.484 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 1.1 ptp180 -149.89 60.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.329 0.585 . . . . 10.0 110.352 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.4 tttm -154.64 150.55 27.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.894 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -72.98 152.65 41.27 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.837 0.351 . . . . 10.0 111.453 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.68 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.9 m -90.32 168.37 11.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.837 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 33' ' ' THR . 11.0 tt0 -114.49 107.75 15.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.782 0.325 . . . . 10.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.021 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.6 t70 -157.94 -82.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.337 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 178.6 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 O-C-N 123.482 0.489 . . . . 10.0 110.614 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.294 -0.86 . . . . 10.0 110.689 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.3 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.935 0.398 . . . . 10.0 110.512 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -77.7 135.55 38.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.406 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 94.4 t -120.67 118.84 57.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.991 0.424 . . . . 10.0 110.563 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.613 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 59.2 m-85 -106.19 112.01 24.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.057 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -127.37 158.8 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.82 0.343 . . . . 10.0 111.179 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.579 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.9 mtm -127.0 107.28 9.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.636 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.445 ' HB ' ' HB ' ' B' ' 14' ' ' ILE . 48.6 mm -78.43 106.33 8.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -101.75 101.52 12.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.259 0.552 . . . . 10.0 112.487 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.742 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.6 ttp85 -91.72 72.56 5.81 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.377 -1.342 . . . . 10.0 107.377 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.658 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.7 t-160 67.6 -80.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.075 -177.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 58.1 mttt -116.02 -5.46 11.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.97 0.414 . . . . 10.0 111.132 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.742 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 3.0 m -96.58 94.6 7.44 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 2.9 m -95.86 112.31 24.07 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.939 0.4 . . . . 10.0 110.851 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.8 mt -106.37 116.8 50.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.988 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -77.15 116.83 18.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.72 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -112.1 112.29 23.8 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.335 0.588 . . . . 10.0 111.854 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.895 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.3 t70 -100.76 103.48 14.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.432 -1.321 . . . . 10.0 107.432 178.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.13 -164.39 1.28 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.314 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -125.4 153.55 43.24 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.23 -27.35 61.95 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.169 0.433 . . . . 10.0 112.169 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -8.6 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 16.4 m -84.4 147.61 27.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.622 0.249 . . . . 10.0 110.704 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 8.2 p -92.42 163.47 13.84 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.313 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 83.5 t -64.0 -36.71 77.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.591 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.17 -32.51 71.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' B' ' 29' ' ' ARG . 39.1 mt-10 -67.3 -31.59 71.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.066 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.494 HD11 HD21 ' B' ' 57' ' ' LEU . 85.1 mt -62.26 -42.38 99.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.705 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 94.9 mttt -62.95 -37.35 86.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.061 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' B' ' 26' ' ' GLU . 81.6 mtp180 -61.84 -43.22 99.29 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.968 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.09 -48.93 81.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.093 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.6 t -61.14 -36.45 72.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.758 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.494 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.1 tt0 -60.66 -35.02 75.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.148 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.72 -18.52 72.81 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.574 -0.822 . . . . 10.0 112.276 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.3 mt -92.21 -53.46 8.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.749 0.309 . . . . 10.0 111.226 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.4 mt -84.08 -13.28 53.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 mttt 63.01 32.58 15.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.675 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -121.0 138.83 28.3 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.24 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.5 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 77.3 Cg_exo -50.33 135.08 39.07 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.314 2.676 . . . . 10.0 112.895 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.705 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 7.1 Cg_exo -74.02 -16.1 23.04 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.037 2.491 . . . . 10.0 112.521 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.78 -35.99 79.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.027 -0.533 . . . . 10.0 112.028 -178.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -101.49 16.99 23.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -92.29 124.42 36.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.1 mmt-85 -112.24 114.05 26.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.438 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -98.21 113.35 25.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.333 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' TYR . . . . . 0.464 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 94.2 m-85 -112.21 122.59 48.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.696 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.555 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 30.5 tttm -124.99 130.29 52.06 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.17 35.83 18.31 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.472 0.482 . . . . 10.0 110.488 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 68.94 12.43 8.62 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.212 -0.904 . . . . 10.0 112.908 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -129.12 157.29 42.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.884 0.373 . . . . 10.0 111.496 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.35 143.35 33.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.405 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 46' ' ' LYS . 93.6 mt -93.05 156.68 16.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.243 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.434 ' OD2' ' HG3' ' B' ' 55' ' ' LYS . 15.2 t0 -92.98 119.88 32.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.788 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -57.57 -31.89 66.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.056 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.01 -3.74 90.64 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.611 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.434 ' HG3' ' OD2' ' B' ' 52' ' ' ASP . 41.3 mttp -101.1 153.72 19.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.47 . . . . 10.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.8 p -88.4 167.97 13.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.197 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.494 HD21 HD11 ' B' ' 27' ' ' LEU . 67.8 mt -60.49 -42.83 97.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 10.0 110.74 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.44 -41.52 98.62 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.622 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.24 -29.29 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.312 . . . . 10.0 111.686 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.7 m -79.85 -5.73 56.03 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.93 10.03 41.11 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.584 -0.817 . . . . 10.0 113.312 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 52.7 m-85 -79.96 67.39 5.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.179 0.514 . . . . 10.0 110.828 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.51 155.16 23.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.053 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -26.32 63.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.0 0.428 . . . . 10.0 111.728 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.11 -26.51 64.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.399 . . . . 10.0 110.917 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.69 -51.91 4.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.616 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.613 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -89.45 95.86 10.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.502 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -109.8 156.14 40.33 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.084 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.26 -14.36 37.55 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.306 2.004 . . . . 10.0 110.407 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.44 -7.4 21.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.995 -1.002 . . . . 10.0 109.956 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.5 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.87 88.61 1.69 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.363 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.579 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 9.0 Cg_exo -74.25 147.74 37.91 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.732 2.288 . . . . 10.0 111.58 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.86 110.27 10.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.999 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.59 119.37 14.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.715 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.407 ' HB ' HD13 ' B' ' 7' ' ' ILE . 41.4 t -115.7 134.83 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.72 126.61 7.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.479 -0.867 . . . . 10.0 112.169 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.444 ' HB2' HG23 ' B' ' 7' ' ' ILE . 23.6 tp -111.12 105.6 14.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.908 0.385 . . . . 10.0 111.049 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.64 124.72 50.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.651 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -95.77 119.0 33.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.797 0.332 . . . . 10.0 110.116 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 18.9 ttp180 -79.66 78.8 6.2 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.923 -0.581 . . . . 10.0 111.099 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -98.52 129.65 45.09 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.692 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -68.18 150.08 48.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.988 -0.551 . . . . 10.0 109.768 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 70.11 7.62 6.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.561 0.538 . . . . 10.0 110.832 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 86' ' ' GLU . 7.0 m -123.12 132.89 54.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.141 -179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -100.46 -4.26 29.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.43 . . . . 10.0 111.011 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.489 ' H ' HG22 ' B' ' 84' ' ' THR . 37.4 tt0 -62.05 -24.63 67.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.686 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.98 74.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.871 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.65 -14.38 60.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.807 0.336 . . . . 10.0 111.666 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 51.2 m -84.18 -28.31 27.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.134 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.658 HG12 ' HB2' ' B' ' 10' ' ' HIS . 22.6 mt -94.51 -25.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.531 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.464 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 43.2 tt0 -69.41 112.63 12.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.67 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' B' ' 95' ' ' SER . 14.4 Cg_exo -72.0 -10.95 26.84 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.262 2.642 . . . . 10.0 111.416 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -74.85 -33.17 62.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.243 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -102.51 -40.17 6.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.549 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.603 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 6.8 m -119.43 142.63 32.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.535 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.38 152.97 80.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.765 2.31 . . . . 10.0 111.99 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.43 126.35 22.18 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.084 2.522 . . . . 10.0 112.193 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -66.14 112.71 4.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.787 -0.642 . . . . 10.0 111.77 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 32.2 tp -139.34 120.57 9.77 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.498 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.84 128.59 31.08 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.069 2.513 . . . . 10.0 112.076 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -59.62 -31.78 69.81 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.949 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.455 ' HB ' HG12 ' A' ' 29' ' ' VAL . 19.3 m -71.03 -17.55 20.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.19 0.519 . . . . 10.0 111.338 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.418 ' HG2' HG23 ' B' ' 102' ' ' VAL . 81.0 mmm -122.56 58.29 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.664 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 23.4 ttpt -135.02 -54.48 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.492 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -75.55 60.36 5.81 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.612 2.208 . . . . 10.0 112.218 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -123.44 -156.68 0.72 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.157 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.579 ' HB2' HE22 ' B' ' 118' ' ' GLN . 16.4 t0 -113.15 172.53 6.89 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.923 -0.311 . . . . 10.0 110.443 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 15.9 m -99.97 136.28 40.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.058 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.34 -144.99 9.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.563 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -35.95 11.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.925 0.393 . . . . 10.0 110.655 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.597 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 49.9 m -80.59 158.37 25.75 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.382 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ALA . . . . . 0.409 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.65 123.71 20.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.908 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 73.17 5.6 5.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.761 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.597 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 45.6 tt0 -71.6 131.5 43.3 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 179.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -110.36 138.93 46.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.077 0.465 . . . . 10.0 111.529 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -108.88 111.21 22.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.807 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.575 ' H ' HD11 ' C' ' 81' ' ' ILE . 2.6 t -81.17 123.94 38.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.754 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.579 HE22 ' HB2' ' B' ' 107' ' ' ASP . 24.0 mp0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.176 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.147 0.498 . . . . 10.0 110.798 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.938 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 75.6 tttt -108.88 122.83 48.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.91 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.496 HD22 ' HE2' ' C' ' 44' ' ' PHE . 25.1 mt -101.32 120.46 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.534 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.693 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.6 mt -105.65 115.81 48.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -87.13 173.69 9.09 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.919 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.9 m -68.17 -21.19 64.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.244 0.545 . . . . 10.0 110.704 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.81 -8.4 56.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.685 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.41 12.09 73.71 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.573 -0.822 . . . . 10.0 111.461 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 9' ' ' HIS . . . . . 0.404 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -81.04 134.46 35.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.938 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 6.7 mt-10 -103.56 106.93 17.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.265 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -98.31 109.99 22.65 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.714 0.292 . . . . 10.0 111.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.593 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 14.6 mm -94.38 112.81 27.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.39 133.74 42.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.718 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.895 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.6 tttt -59.3 128.64 38.12 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -53.88 -35.19 61.3 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.239 0.337 . . . . 10.0 111.674 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -56.74 -40.28 75.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.145 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -86.32 -33.33 20.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.066 0.46 . . . . 10.0 110.084 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.86 -40.04 93.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.344 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.34 -47.18 86.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.309 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.442 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.0 OUTLIER -65.32 -40.06 93.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.691 179.495 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -65.29 -36.72 84.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.167 0.508 . . . . 10.0 109.824 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.27 -6.58 86.46 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.268 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -79.12 -27.33 42.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -83.38 143.32 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -66.49 95.42 0.32 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.471 . . . . 10.0 111.317 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -98.85 -171.3 2.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.144 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.525 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.8 mmm -79.59 31.81 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.847 0.356 . . . . 10.0 111.952 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 16.3 tp -66.17 -39.23 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.316 0.579 . . . . 10.0 110.016 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.51 7.04 24.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.593 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.95 -64.72 3.71 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.655 -0.702 . . . . 10.0 112.583 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.99 173.4 8.39 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.473 2.116 . . . . 10.0 111.666 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.96 -63.64 5.14 Favored Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.968 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -140.04 125.02 18.5 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.892 0.377 . . . . 10.0 110.134 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -88.25 110.16 20.51 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.287 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.5 152.82 28.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.218 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 36' ' ' GLU . . . . . 0.515 ' H ' ' HG3' ' C' ' 36' ' ' GLU . 1.5 mt-10 -62.33 -33.93 75.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.231 0.539 . . . . 10.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.58 -35.78 78.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.34 -0.846 . . . . 10.0 109.545 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.4 ' O ' HG22 ' C' ' 42' ' ' VAL . 41.7 tp10 -77.36 -22.84 51.12 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.452 -0.795 . . . . 10.0 110.023 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -73.86 -34.31 64.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.19 0.519 . . . . 10.0 109.739 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -70.73 -47.26 60.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.756 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.693 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.5 mt-10 -133.0 97.22 3.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.743 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.4 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.5 t -83.11 125.77 40.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.07 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -94.14 111.34 23.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.935 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.496 ' HE2' HD22 ' C' ' 3' ' ' LEU . 64.7 m-85 -102.08 110.7 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.399 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -101.06 144.9 29.42 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.799 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 69.71 22.7 6.02 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.86 0.725 . . . . 10.0 110.491 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 76.6 mt -131.51 107.21 14.43 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.335 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -64.72 156.64 60.38 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 123.069 2.513 . . . . 10.0 112.249 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.6 p -69.12 -34.89 75.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.577 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -35.77 76.47 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.688 0.625 . . . . 10.0 112.688 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.436 ' O ' HG23 ' C' ' 55' ' ' VAL . 32.9 m -87.37 -31.37 5.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.401 -0.52 . . . . 10.0 111.209 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.68 -33.89 75.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.277 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -40.59 98.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.823 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 54' ' ' LYS . . . . . 0.491 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 60.0 tttp -64.49 -37.97 89.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.436 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.0 t -63.83 -46.25 94.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.83 -43.19 98.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.852 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.16 -38.78 91.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.874 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.596 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 83.5 t80 -64.6 -42.88 95.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.525 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.476 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.5 m-85 -62.37 -44.86 95.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.541 . . . . 10.0 109.912 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 29.1 m -60.0 -43.3 95.28 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.992 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -63.65 -42.17 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.173 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 12.6 tptt -64.3 -37.27 86.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.131 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.476 HG23 ' O ' ' C' ' 59' ' ' PHE . 55.6 t -60.28 -50.31 80.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.8 mmt180 -70.78 -31.27 67.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.442 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -62.52 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.091 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -75.7 -15.94 60.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.966 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.04 -55.77 4.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.945 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.5 p -145.95 -34.31 0.31 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.693 0.627 . . . . 10.0 112.693 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.469 ' O ' HG12 ' C' ' 72' ' ' ILE . 9.8 m -78.4 44.4 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.106 0.479 . . . . 10.0 112.216 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -18.35 26.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.552 0.691 . . . . 10.0 109.796 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 71' ' ' GLU . . . . . 0.466 ' HG2' ' H ' ' C' ' 71' ' ' GLU . 1.6 pt-20 -89.1 8.46 29.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.513 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.469 HG12 ' O ' ' C' ' 69' ' ' SER . 18.0 pt -111.21 163.92 16.2 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.14 149.9 82.34 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.466 2.111 . . . . 10.0 112.676 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -70.66 165.45 22.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.32 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -45.31 128.66 5.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.285 0.365 . . . . 10.0 111.151 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.76 5.4 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.077 2.518 . . . . 10.0 112.482 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 16' ' ' LEU . 7.2 pt -79.54 57.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.5 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -118.8 -55.22 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.483 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 39.6 Cg_exo -58.47 107.59 0.34 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.987 1.791 . . . . 10.0 112.187 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -72.61 57.02 0.4 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.761 -0.654 . . . . 10.0 112.6 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 81' ' ' ILE . . . . . 0.575 HD11 ' H ' ' B' ' 117' ' ' VAL . 8.1 mm -125.24 -4.35 5.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.348 0.594 . . . . 10.0 109.919 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.68 -43.7 68.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.566 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 29.8 tp -67.1 -29.9 69.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.379 0.609 . . . . 10.0 109.425 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.481 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 12.3 mp0 -64.23 -34.74 78.8 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.459 178.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.649 ' HB3' HD21 ' A' ' 8' ' ' LEU . 89.4 mt -76.47 -27.82 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.265 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.459 HD12 HD12 ' C' ' 83' ' ' LEU . 94.6 mt -73.06 -15.69 61.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.776 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 87' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 51.9 ttp -61.91 -26.12 67.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.695 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.69 83.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.76 -58.21 0.44 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.902 0.751 . . . . 10.0 112.59 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -82.65 50.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.516 0.674 . . . . 10.0 110.337 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.519 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.87 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.652 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.76 -0.136 . . . . 10.0 112.76 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -68.63 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.69 0.626 . . . . 10.0 112.69 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.517 HD22 ' HD2' ' C' ' 91' ' ' PHE . 4.3 mp -66.3 -21.67 66.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.652 HE21 ' N ' ' A' ' 6' ' ' GLY . 8.3 tt0 -51.73 -31.96 28.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.335 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -115.49 -35.0 4.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.007 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.506 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.1 mt -63.0 -36.07 82.34 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.546 0.573 . . . . 10.0 112.546 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.54 72.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.682 0.277 . . . . 10.0 111.257 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.1 tp -68.31 -32.04 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.162 0.506 . . . . 10.0 110.667 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.07 -18.1 50.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.741 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 -11.68 29.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.055 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.558 ' HA ' HG22 ' C' ' 77' ' ' ILE . 12.7 tp -165.21 113.56 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.221 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.8 mt -90.14 78.72 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 71.0 tttt -107.37 102.55 44.58 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.643 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -91.99 53.1 0.69 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.946 2.431 . . . . 10.0 111.697 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -100.63 -177.15 3.4 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.918 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -86.77 152.7 22.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.767 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.444 HG23 HD22 ' A' ' 32' ' ' LEU . 29.8 mm -120.49 105.92 17.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.679 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.002 ' HG2' ' HD2' ' A' ' 24' ' ' PRO . 4.4 tttp -120.2 146.23 42.03 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 1.002 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 33.1 Cg_exo -32.87 133.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 124.227 3.285 . . . . 10.0 113.5 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.792 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 31.0 Cg_endo -62.24 155.27 57.73 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 123.216 2.611 . . . . 10.0 113.401 -178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 122.96 63.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.477 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.78 -16.11 51.27 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.457 2.771 . . . . 10.0 112.893 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -42.26 98.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 10.0 110.121 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.4 t -120.99 -113.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.709 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.7 ptp180 -171.9 57.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.062 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.46 ' HG3' ' HG2' ' C' ' 84' ' ' GLU . 20.3 tttm -152.8 151.92 31.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.134 -179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.792 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.8 pp -72.0 156.28 39.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.683 0.277 . . . . 10.0 110.977 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -96.43 161.82 13.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.475 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -101.69 124.95 48.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.657 -0.498 . . . . 10.0 109.657 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.654 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 9.5 t70 -174.91 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.109 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.7 -64.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.516 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.0 m0 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.141 -0.933 . . . . 10.0 109.281 179.796 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmm . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 120.831 0.348 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -177.93 104.1 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.657 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.508 HG11 HD13 ' B' ' 57' ' ' LEU . 55.5 t -119.56 123.66 71.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.282 0.563 . . . . 10.0 111.78 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.01 116.67 31.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.237 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.656 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -126.65 151.33 48.2 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.182 0.515 . . . . 10.0 112.326 -179.061 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 41.7 mtm -122.3 104.58 9.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.137 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.48 HD11 HD12 ' B' ' 5' ' ' LEU . 44.7 mm -81.75 104.24 10.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.58 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.4 ttt180 -101.54 104.31 15.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.0 ttp85 -91.93 69.79 5.48 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.493 ' CE1' ' HE2' ' B' ' 11' ' ' LYS . 6.7 t-160 66.98 -79.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.343 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.493 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 71.1 mmtt -110.03 -11.29 14.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.643 0.259 . . . . 10.0 111.345 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 102.93 12.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.646 -0.252 . . . . 10.0 110.887 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 17.8 m -101.72 124.29 47.12 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.872 0.368 . . . . 10.0 110.914 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.452 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.1 mt -116.41 122.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.987 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -84.66 122.65 29.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.851 0.358 . . . . 10.0 110.144 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.656 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -117.96 130.17 56.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.491 . . . . 10.0 111.634 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -110.74 103.89 12.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.97 -168.65 2.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.453 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -129.49 161.22 30.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 3.8 mp0 -54.26 -28.13 39.56 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.5 m -68.08 -25.43 65.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.4 m -73.24 137.4 44.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.619 0.247 . . . . 10.0 110.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 73.6 p -87.98 167.28 13.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.875 0.369 . . . . 10.0 111.181 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.751 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 70.7 t -65.1 -35.53 75.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.102 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' PHE . . . . . 0.672 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 52.5 t80 -62.19 -34.96 77.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.172 0.51 . . . . 10.0 110.517 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.406 ' O ' HG13 ' B' ' 30' ' ' ILE . 34.1 mt-10 -66.38 -31.17 71.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.847 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.917 HD11 HD21 ' B' ' 57' ' ' LEU . 63.8 mt -66.32 -43.98 84.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 10.0 109.949 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.07 -34.66 75.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -67.96 -32.96 73.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.447 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.406 HG13 ' O ' ' B' ' 26' ' ' GLU . 82.7 mt -69.5 -46.69 75.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -63.48 -35.07 71.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.542 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.6 tm-20 -60.53 -38.03 83.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.291 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.15 1.05 71.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.729 -0.748 . . . . 10.0 112.946 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.56 -56.05 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.891 0.377 . . . . 10.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.75 -13.72 44.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.503 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 90.9 mttt 61.7 31.64 18.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.728 -0.669 . . . . 10.0 112.166 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -105.04 142.86 25.53 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.654 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.16 125.22 17.48 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.893 2.395 . . . . 10.0 112.496 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.542 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 30.5 Cg_endo -64.11 -21.36 67.91 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.953 2.435 . . . . 10.0 112.322 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.31 -29.75 70.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -96.11 -4.07 43.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.78 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.9 135.19 35.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.935 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.486 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 80.8 mmt-85 -127.14 110.21 12.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.81 111.66 23.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.904 0.383 . . . . 10.0 110.661 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -107.44 109.95 21.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.758 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.483 ' HB3' HD21 ' B' ' 51' ' ' LEU . 7.8 tttt -118.52 134.01 55.42 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 62.35 32.0 17.1 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.253 0.549 . . . . 10.0 109.715 -178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 67.93 10.54 7.87 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.021 -0.991 . . . . 10.0 112.066 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -124.59 151.37 44.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.017 0.437 . . . . 10.0 111.303 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.8 tp -74.83 126.44 30.95 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.185 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.549 ' HB3' HG21 ' B' ' 24' ' ' VAL . 89.4 mt -72.48 153.54 41.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.899 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -93.1 112.34 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.961 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.751 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.7 m-20 -60.31 -27.24 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.137 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.66 -12.79 83.25 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.942 -0.647 . . . . 10.0 112.714 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -102.27 161.49 13.66 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.876 0.369 . . . . 10.0 111.038 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.6 p -90.97 172.9 8.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.885 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.917 HD21 HD11 ' B' ' 27' ' ' LEU . 87.1 mt -62.39 -29.61 70.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.525 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.49 -43.96 98.63 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.131 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -75.08 -15.21 60.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.76 0.282 . . . . 10.0 111.76 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 53.5 m -95.84 15.35 20.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.825 0.345 . . . . 10.0 111.782 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.37 41.56 96.46 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.017 -0.611 . . . . 10.0 113.115 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.502 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 23.4 m-85 -101.97 48.62 0.87 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.002 0.43 . . . . 10.0 110.228 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.01 149.79 49.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.512 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -22.69 65.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.977 0.418 . . . . 10.0 111.717 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.2 mm-40 -72.81 -32.03 65.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.066 0.46 . . . . 10.0 110.418 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.81 -37.97 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.797 179.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.5 92.14 3.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.508 -0.769 . . . . 10.0 109.138 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' OE1' ' B' ' 70' ' ' GLN . 7.8 mtt180 -106.74 163.5 16.85 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.775 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 29.0 Cg_endo -65.23 -16.27 53.97 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.334 2.023 . . . . 10.0 111.2 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.412 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -107.34 1.28 23.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.613 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.515 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -161.8 82.84 1.79 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.577 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.534 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -74.88 143.43 29.48 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.923 2.416 . . . . 10.0 111.987 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.77 118.05 13.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.805 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.76 123.26 26.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.44 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.456 ' HB ' HD13 ' B' ' 7' ' ' ILE . 34.9 t -122.99 136.32 60.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.26 134.38 12.4 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.73 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.47 102.76 10.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.897 0.38 . . . . 10.0 111.838 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.486 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.43 130.74 38.02 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -111.59 116.48 30.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.629 0.252 . . . . 10.0 110.998 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -70.99 104.25 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.179 0.514 . . . . 10.0 111.005 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -122.01 126.97 49.72 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.804 -0.634 . . . . 10.0 109.367 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -66.29 133.27 50.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.953 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 76.26 -22.38 0.28 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.265 0.839 . . . . 10.0 113.265 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.4 m -85.25 106.39 16.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.994 0.426 . . . . 10.0 110.429 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -77.51 -4.36 45.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.163 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -60.07 -30.95 69.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.916 0.388 . . . . 10.0 110.897 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.54 -34.2 66.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.964 -0.562 . . . . 10.0 112.471 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.76 -30.04 69.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.4 m -79.6 -12.35 59.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.701 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 mt -100.29 -0.85 10.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 10.0 111.098 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 32.9 tt0 -97.81 110.89 57.36 Favored Pre-proline 0 C--N 1.323 -0.553 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -70.73 2.49 4.02 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.257 2.638 . . . . 10.0 112.383 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.553 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 19.0 t80 -94.1 -18.67 21.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.213 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.4 p -118.94 -42.11 2.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.165 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.3 m -106.52 153.33 40.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.991 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.04 159.09 23.91 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.382 2.055 . . . . 10.0 111.366 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.66 126.23 20.01 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.585 2.19 . . . . 10.0 111.591 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -70.99 103.81 2.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.505 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.6 tp -131.38 126.54 21.33 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.447 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.646 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 51.1 Cg_exo -54.67 134.07 60.4 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.819 2.346 . . . . 10.0 111.768 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.01 -37.64 88.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.272 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.6 m -73.51 -15.95 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.324 0.583 . . . . 10.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.646 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 89.7 mmm -112.78 39.14 2.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.508 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.63 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.2 ttpt -115.76 -53.74 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.169 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 9.9 Cg_exo -73.11 69.77 3.85 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 122.314 2.01 . . . . 10.0 111.553 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.2 mt-30 -137.1 170.68 15.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.608 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 4.7 t0 -85.63 175.54 8.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.785 0.326 . . . . 10.0 110.794 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.3 m -96.63 143.65 27.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.348 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' GLY . . . . . 0.5 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.18 -153.21 29.67 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.213 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -33.73 13.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.212 0.529 . . . . 10.0 110.877 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.515 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 50.8 m -89.09 163.41 15.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.879 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.61 132.13 45.72 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.041 -0.725 . . . . 10.0 109.041 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.85 -0.28 3.41 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.709 0.63 . . . . 10.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.5 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 35.7 tt0 -76.49 131.61 39.11 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -115.48 151.33 34.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.053 0.454 . . . . 10.0 111.365 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -118.21 106.02 12.38 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.046 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.623 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -69.52 127.86 32.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.809 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' B' ' 106' ' ' GLN . 11.6 mp0 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.412 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.134 0.492 . . . . 10.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.68 ' HE2' HG12 ' C' ' 4' ' ' ILE . 61.5 tttt -105.42 121.93 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.586 -0.734 . . . . 10.0 110.847 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.632 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.1 mt -95.7 115.06 26.88 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.724 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.9 mt -98.7 109.78 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.5 p -83.33 170.82 14.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.73 0.3 . . . . 10.0 110.975 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.1 m -67.84 -19.8 65.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.886 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -82.91 -4.87 58.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.079 0.466 . . . . 10.0 110.296 179.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.22 65.57 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.406 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.96 130.49 34.53 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -95.17 117.16 29.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.238 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.632 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 87.9 m-85 -108.25 106.47 16.65 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.686 0.279 . . . . 10.0 110.882 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.452 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.3 mm -94.34 116.54 35.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.63 136.17 43.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.591 0.234 . . . . 10.0 110.88 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -58.62 129.37 41.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 26.9 ttt180 -57.94 -25.53 61.04 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 112.683 0.623 . . . . 10.0 112.683 -178.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -55.17 -49.81 70.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.198 0.523 . . . . 10.0 110.149 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -77.95 -32.14 51.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.864 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -63.06 -37.22 86.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.342 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 64.8 mt -59.98 -52.4 65.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.978 0.418 . . . . 10.0 110.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.47 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.7 m -62.1 -44.21 97.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.6 m -62.1 -38.78 90.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.996 0.427 . . . . 10.0 110.848 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.29 -10.11 78.16 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.066 -0.588 . . . . 10.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 23.6 m -86.5 -25.17 25.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.249 0.547 . . . . 10.0 109.582 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 24' ' ' ILE . . . . . 0.556 HG22 ' H ' ' C' ' 25' ' ' LYS . 6.5 mt -75.1 170.61 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.883 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 25' ' ' LYS . . . . . 0.556 ' H ' HG22 ' C' ' 24' ' ' ILE . 31.8 tttp -73.29 78.33 1.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 10.0 110.681 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.14 9.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.796 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.644 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 87.3 mmm -80.31 45.18 0.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.712 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tt -70.24 -37.5 74.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.045 0.45 . . . . 10.0 110.233 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.73 12.91 13.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.841 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.3 -60.97 6.13 Favored Glycine 0 CA--C 1.523 0.537 0 CA-C-N 115.789 -0.641 . . . . 10.0 113.027 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -67.91 -178.31 1.61 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.621 2.214 . . . . 10.0 112.253 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.3 -49.08 68.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.891 -0.671 . . . . 10.0 112.158 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -149.69 133.38 16.81 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.23 100.8 12.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.032 0.444 . . . . 10.0 110.352 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.48 159.13 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.042 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.3 -28.59 63.19 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -61.83 -42.54 99.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.046 0.45 . . . . 10.0 110.083 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.492 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.2 tp10 -72.8 -20.29 61.18 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -79.78 -32.0 40.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.209 0.528 . . . . 10.0 109.621 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -75.04 -51.05 14.51 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.724 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.7 mt-10 -131.55 106.63 8.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.76 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.492 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -92.82 115.07 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.535 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -90.15 113.75 25.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.979 0.419 . . . . 10.0 111.176 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.56 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.4 m-85 -102.26 103.13 13.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -92.35 148.44 22.13 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 69.1 17.57 8.45 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.808 0.693 . . . . 10.0 110.716 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.436 HD12 ' HB3' ' C' ' 44' ' ' PHE . 77.8 mt -129.84 108.17 16.91 Favored Pre-proline 0 C--O 1.237 0.425 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.793 -179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.33 149.39 91.36 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.069 2.512 . . . . 10.0 112.504 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 6.4 p -62.77 -40.07 96.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.576 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.72 -53.15 58.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 10.0 112.257 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.2 m -68.21 -34.47 66.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.904 -0.319 . . . . 10.0 111.217 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.17 -30.8 71.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.946 0.403 . . . . 10.0 110.332 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -62.97 -40.57 98.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.499 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -68.1 -35.13 77.66 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.284 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 61.4 t -63.18 -46.32 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.619 179.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.31 -41.59 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.902 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 63.3 mtm -65.66 -40.76 92.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.914 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.506 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.6 t80 -64.28 -42.22 96.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.603 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.42 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.3 m-85 -62.94 -44.5 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.278 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 43.4 m -58.88 -43.09 90.86 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.488 0.661 . . . . 10.0 109.794 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.59 -43.43 84.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.117 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -61.42 -39.68 91.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.362 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.47 HG22 ' HB ' ' C' ' 20' ' ' THR . 46.4 t -60.43 -45.03 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.416 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -77.31 -38.83 49.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.72 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.587 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -55.21 -52.39 63.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.491 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.7 50.59 1.92 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.599 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -158.56 -54.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.438 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -139.77 -38.08 0.48 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.279 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.587 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -80.06 40.18 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.917 0.389 . . . . 10.0 111.769 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.7 -8.03 56.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.291 0.567 . . . . 10.0 110.244 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -79.72 -27.71 40.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.149 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.674 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 27.5 pt -92.22 165.3 20.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.842 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.674 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 70.4 Cg_endo -73.68 -178.33 3.68 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.329 2.019 . . . . 10.0 113.422 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -78.58 173.37 12.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.32 -0.854 . . . . 10.0 108.907 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.31 129.77 51.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 123.104 0.252 . . . . 10.0 110.445 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.3 123.02 10.35 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.121 2.548 . . . . 10.0 112.534 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.558 HG22 ' HA ' ' A' ' 16' ' ' LEU . 23.0 pt -82.09 38.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.494 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.468 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -92.57 -57.03 0.24 Allowed Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 10.0 112.081 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 37.8 Cg_endo -66.78 103.48 0.71 Allowed 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.119 1.879 . . . . 10.0 111.189 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.648 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 26.4 mt-10 -76.71 51.93 0.79 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.708 0.633 . . . . 10.0 112.708 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 27.8 mm -118.34 -9.18 11.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.479 0.657 . . . . 10.0 110.096 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.3 -29.31 66.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.255 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.483 HD22 ' HG2' ' A' ' 18' ' ' LYS . 11.6 tp -73.25 -26.14 60.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.181 0.515 . . . . 10.0 110.165 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.498 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 5.4 mp0 -63.7 -27.36 69.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.715 179.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 8' ' ' LEU . 43.1 mt -76.85 -23.87 52.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.897 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 53.1 tp -72.53 -12.63 61.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.516 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 48.3 ttp -62.53 -29.13 70.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.983 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.54 78.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.687 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.81 -51.36 0.68 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.934 0.716 . . . . 10.0 112.934 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -83.76 34.32 0.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.221 0.534 . . . . 10.0 110.773 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.517 ' HD2' HD22 ' A' ' 8' ' ' LEU . 4.1 t80 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.639 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 112.102 -0.399 . . . . 10.0 112.102 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.73 -61.37 2.23 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.52 0.563 . . . . 10.0 112.52 -179.063 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.549 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.5 tp -63.6 -30.65 71.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.348 -178.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.639 HE21 ' N ' ' A' ' 6' ' ' GLY . 3.6 tt0 -56.7 -26.29 56.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.926 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -106.79 -38.64 6.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.443 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.5 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 62.3 mt -59.6 -39.87 85.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.942 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.06 -38.44 72.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.328 . . . . 10.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.38 -34.25 76.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.102 0.477 . . . . 10.0 110.785 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.9 0.74 46.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.924 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.47 -48.06 3.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.162 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.768 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.1 OUTLIER -140.08 110.02 6.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.89 -179.697 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.8 mt -76.17 114.89 16.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.702 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.812 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 53.2 tttt -126.6 92.03 45.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.873 0.368 . . . . 10.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -83.26 48.52 2.71 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.952 2.434 . . . . 10.0 111.979 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 54.3 mttt -93.15 -170.03 2.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.03 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -96.55 168.4 10.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.02 0.438 . . . . 10.0 111.612 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.0 mm -111.97 151.04 14.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.173 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.932 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -175.28 138.88 0.58 Allowed Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 179.213 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.596 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 53.3 Cg_exo -40.4 137.74 1.46 Allowed 'Trans proline' 0 C--O 1.239 0.566 0 C-N-CA 123.354 2.702 . . . . 10.0 113.058 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.4 Cg_endo -60.57 136.0 64.4 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.044 2.496 . . . . 10.0 112.059 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 31' ' ' LYS . 0.3 OUTLIER -76.18 123.65 88.05 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.643 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.0 -7.65 20.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.001 2.467 . . . . 10.0 112.466 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -36.6 78.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 10.0 111.034 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.571 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.1 t -132.88 -113.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.724 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.571 ' HG2' HG12 ' A' ' 29' ' ' VAL . 3.8 ptp180 -162.16 56.14 0.24 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.211 0.529 . . . . 10.0 110.912 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 tttm -151.57 155.19 37.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.863 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 1.1 pp -84.55 151.69 24.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.705 -0.479 . . . . 10.0 109.705 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HD2' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -86.97 175.92 7.9 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.633 -0.258 . . . . 10.0 110.386 -179.592 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 0.8 OUTLIER -124.47 119.53 29.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.652 0.263 . . . . 10.0 110.845 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.932 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -165.93 -70.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.269 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 175.37 -56.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.454 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.414 ' SD ' ' HD2' ' B' ' 19' ' ' LYS . 9.0 tmm? . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.831 0.348 . . . . 10.0 110.708 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.25 141.91 30.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.826 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.549 ' CG2' ' HG3' ' B' ' 20' ' ' GLU . 76.4 t -128.8 126.78 65.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.128 0.489 . . . . 10.0 110.826 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.405 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 54.4 m-85 -116.39 118.04 31.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.888 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.862 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -131.37 160.75 34.14 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.692 0.282 . . . . 10.0 111.13 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.629 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 58.1 mtm -127.83 108.63 10.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.863 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.599 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.9 mm -82.26 102.71 8.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.5 ttt180 -100.51 105.18 16.6 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.534 0.568 . . . . 10.0 112.534 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.541 ' HB2' HD23 ' B' ' 77' ' ' LEU . 20.6 ttp85 -94.14 82.67 4.17 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.959 -1.497 . . . . 10.0 106.959 177.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.538 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.2 t-80 66.79 -86.15 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.204 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -119.65 6.88 11.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.151 0.5 . . . . 10.0 111.102 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -105.86 95.19 5.62 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 6.4 m -95.09 117.13 29.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.016 0.436 . . . . 10.0 110.943 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.548 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 52.8 mt -108.17 117.23 53.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.555 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -74.04 116.68 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.862 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -107.7 114.22 28.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.234 0.54 . . . . 10.0 111.511 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.901 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 1.4 t70 -103.49 110.6 22.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -141.14 -159.78 1.0 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.979 0.419 . . . . 10.0 111.937 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.414 ' HD2' ' SD ' ' B' ' 1' ' ' MET . 38.0 mmtm -129.86 161.27 31.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.344 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.549 ' HG3' ' CG2' ' B' ' 3' ' ' VAL . 14.1 mt-10 -61.56 -24.49 66.68 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.663 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -16.61 59.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.303 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.469 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 19.2 m -76.04 144.03 41.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.501 0.191 . . . . 10.0 111.015 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 37.9 p -90.15 168.17 12.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.829 0.347 . . . . 10.0 111.042 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.401 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 79.4 t -67.42 -35.59 73.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.852 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 69.2 t80 -63.57 -32.81 74.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.1 0.476 . . . . 10.0 110.515 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.71 -34.08 77.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.417 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.726 HD11 HD21 ' B' ' 57' ' ' LEU . 69.9 mt -63.38 -44.65 94.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -62.1 -35.06 77.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.529 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -66.76 -34.38 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.222 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 85.8 mt -71.18 -45.55 70.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.55 -36.26 72.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.085 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -59.89 -39.82 86.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.66 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.64 -10.17 84.77 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.67 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.5 mt -103.04 -51.75 8.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 111.755 0.28 . . . . 10.0 111.755 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 58.5 mt -89.15 -13.06 39.28 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 57.83 43.5 21.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.399 0.618 . . . . 10.0 112.021 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -127.22 140.68 38.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.259 -0.882 . . . . 10.0 110.033 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -48.99 119.98 4.97 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.403 2.735 . . . . 10.0 112.986 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.72 -16.87 42.43 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.113 2.542 . . . . 10.0 112.258 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.71 -32.78 74.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.567 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -100.74 11.29 39.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.823 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -90.58 126.99 36.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' B' ' 43' ' ' ARG . 37.4 mmt-85 -110.98 123.31 49.93 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.3 121.49 45.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.622 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -119.97 129.84 54.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.814 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.513 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.2 tttm -130.0 129.45 43.75 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 64.93 25.98 12.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.011 0.434 . . . . 10.0 110.287 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 71.98 19.06 4.8 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.27 -0.877 . . . . 10.0 111.235 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -125.94 152.96 44.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.281 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -78.1 137.35 38.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.378 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' B' ' 46' ' ' LYS . 92.8 mt -85.98 165.22 16.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.191 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -112.07 121.18 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.684 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.529 ' HB3' ' HB2' ' B' ' 25' ' ' PHE . 44.7 m-20 -61.83 -28.99 69.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.203 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.98 -5.17 86.39 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.552 -0.832 . . . . 10.0 113.431 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -104.66 157.51 17.13 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.112 0.456 . . . . 10.0 111.433 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.0 p -89.25 165.14 14.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.613 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.726 HD21 HD11 ' B' ' 27' ' ' LEU . 45.8 mt -59.04 -42.48 90.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.313 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.35 -31.62 66.6 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.046 -0.597 . . . . 10.0 112.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -79.73 -23.73 42.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.028 0.442 . . . . 10.0 110.914 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 52.0 m -86.66 0.8 53.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.6 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.77 8.88 57.92 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.977 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.514 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 59.6 m-85 -80.6 98.51 7.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.888 0.375 . . . . 10.0 110.125 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.89 164.41 23.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.7 m -67.86 -10.94 57.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 10.0 112.048 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -77.93 -37.58 47.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.126 0.489 . . . . 10.0 110.066 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -48.08 6.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.852 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -94.26 96.47 9.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.784 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 1.0 OUTLIER -107.34 161.14 24.02 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.547 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 30.1 Cg_endo -65.41 -15.86 51.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.478 2.119 . . . . 10.0 111.481 178.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.75 2.14 23.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.987 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.84 85.91 1.25 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.576 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.629 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.1 Cg_exo -73.29 147.6 42.27 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.739 2.293 . . . . 10.0 111.334 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.97 116.23 11.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.02 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.74 117.13 11.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.443 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.599 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.5 t -117.01 133.68 62.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.67 128.7 9.24 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.657 -0.782 . . . . 10.0 112.409 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 9' ' ' ARG . 23.7 tp -113.11 114.35 26.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 10.0 111.022 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.95 124.61 53.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.657 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -100.5 113.58 26.48 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -77.32 112.74 14.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.963 0.411 . . . . 10.0 111.54 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.54 147.83 52.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.524 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 83' ' ' ASP . 32.0 t70 -71.46 139.62 49.71 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.07 -0.344 . . . . 10.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' B' ' 82' ' ' ASP . 19.4 t70 77.92 -31.0 0.16 Allowed 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.603 0.564 . . . . 10.0 112.224 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.9 m -83.3 95.11 8.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 10.0 111.059 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -74.23 -4.01 33.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.202 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.475 ' O ' HG13 ' B' ' 90' ' ' ILE . 35.4 tt0 -56.26 -32.44 64.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.663 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.07 76.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.209 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.2 mt -72.68 -18.76 61.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.978 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.15 -11.46 38.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.405 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.538 HG12 ' HB2' ' B' ' 10' ' ' HIS . 53.4 mt -101.44 -31.59 3.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.431 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.61 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 39.2 tt0 -66.03 114.15 15.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.484 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.516 ' HA ' ' O ' ' B' ' 95' ' ' SER . 8.4 Cg_exo -74.0 -0.65 9.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.1 2.533 . . . . 10.0 111.354 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.61 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 12.7 t80 -86.66 -16.09 37.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.987 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.24 -42.88 2.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.859 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 10.5 m -113.23 150.49 43.1 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.83 154.95 66.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.593 2.195 . . . . 10.0 111.553 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.73 130.6 37.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.882 2.388 . . . . 10.0 112.496 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.97 102.22 1.95 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.909 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.7 tp -140.27 130.0 13.55 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.833 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.458 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 50.1 Cg_exo -56.41 131.77 47.75 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.992 2.461 . . . . 10.0 111.803 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' ASP . . . . . 0.983 ' HA ' ' HD3' ' B' ' 104' ' ' LYS . 27.6 t0 -65.6 -34.42 78.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.486 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -68.97 -20.36 24.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.286 0.565 . . . . 10.0 110.532 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.458 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 65.4 mmm -107.6 54.97 0.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.65 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.983 ' HD3' ' HA ' ' B' ' 101' ' ' ASP . 32.9 mtpt -133.62 -47.71 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.97 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.839 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 64.6 Cg_endo -72.95 45.23 0.88 Allowed 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.166 1.911 . . . . 10.0 113.493 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 8.6 mp0 -119.38 175.0 6.03 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.649 -0.501 . . . . 10.0 109.649 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -90.49 165.86 13.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.637 0.256 . . . . 10.0 110.379 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 50.7 m -89.99 143.85 26.42 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.211 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' GLY . . . . . 0.487 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -83.96 -150.75 11.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.259 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.26 -27.93 15.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.36 0.6 . . . . 10.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.924 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 0.7 OUTLIER -96.68 165.72 12.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.273 -0.876 . . . . 10.0 110.871 -179.347 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.79 138.18 46.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.612 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 68.52 4.79 4.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.823 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.487 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 34.9 tt0 -86.07 128.93 34.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -114.67 141.68 47.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.941 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.21 101.17 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.845 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 3.7 t -74.04 133.97 30.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.787 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.994 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.893 0.378 . . . . 10.0 110.923 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.435 ' HE2' HG12 ' C' ' 4' ' ' ILE . 44.9 tttt -108.84 113.8 27.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.961 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.531 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 26.2 mt -91.29 127.83 36.88 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.435 HG12 ' HE2' ' C' ' 2' ' ' LYS . 8.2 mt -113.14 120.61 63.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.489 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -94.31 166.52 12.04 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.126 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -1.24 11.83 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.198 0.444 . . . . 10.0 112.198 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -95.06 2.96 55.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.851 0.357 . . . . 10.0 110.216 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.06 33.54 57.0 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.78 -0.724 . . . . 10.0 111.433 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -108.65 128.4 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -97.02 121.67 39.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.896 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.531 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 81.7 m-85 -112.35 110.03 20.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.601 0.239 . . . . 10.0 110.585 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.548 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 21.6 mm -96.06 116.03 36.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.9 t -104.72 135.9 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.406 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.901 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 22.2 tttt -58.97 131.89 52.39 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 65.8 ttt180 -57.89 -34.86 70.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 10.0 112.013 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.436 ' HB2' ' HD3' ' C' ' 14' ' ' LYS . 31.3 mt-10 -56.78 -38.11 72.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.693 0.282 . . . . 10.0 111.411 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -82.96 -32.67 26.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.141 0.496 . . . . 10.0 110.083 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.82 -29.72 70.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.89 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.8 mt -59.29 -55.9 28.96 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.417 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.8 -40.1 96.32 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.283 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.0 m -62.2 -35.34 78.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.469 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.44 -18.18 79.95 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.092 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 14.0 m -79.76 -28.57 40.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.089 0.471 . . . . 10.0 109.765 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mt -74.53 149.76 7.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.158 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.61 113.47 6.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 10.0 110.414 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -134.06 177.57 7.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.871 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.517 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.4 mmm -78.87 38.06 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.894 0.378 . . . . 10.0 111.581 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.64 -37.73 85.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.23 0.538 . . . . 10.0 110.019 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.5 m -91.56 18.58 7.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.314 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.53 -60.55 5.74 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.671 -0.695 . . . . 10.0 112.834 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.84 172.02 7.71 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.356 2.038 . . . . 10.0 112.311 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.23 -55.18 27.74 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 115.885 -0.598 . . . . 10.0 113.167 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -149.67 110.48 4.3 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.505 -0.409 . . . . 10.0 111.11 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -77.27 90.6 3.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.087 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.4 171.83 14.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.137 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.07 -33.59 69.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.329 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -60.85 -44.13 97.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.156 0.503 . . . . 10.0 109.85 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.431 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.0 mp0 -72.6 -26.21 61.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.685 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 10.4 m -74.07 -35.41 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.248 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -76.48 -50.92 12.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.109 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.425 ' HB3' HD11 ' C' ' 4' ' ' ILE . 29.9 mt-10 -124.8 107.32 10.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.302 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.431 HG22 ' O ' ' C' ' 38' ' ' GLU . 3.4 t -92.89 103.66 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.972 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -90.14 119.48 30.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.977 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.609 ' HB3' HD12 ' C' ' 47' ' ' ILE . 87.1 m-85 -98.81 142.29 30.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.214 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -112.58 135.72 52.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.405 -0.362 . . . . 10.0 111.609 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 64.92 19.48 11.86 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.47 -0.786 . . . . 10.0 112.197 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.609 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.0 mt -114.74 107.46 50.57 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.396 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 45.2 Cg_exo -59.71 149.52 82.39 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 123.191 2.594 . . . . 10.0 112.377 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -65.01 -35.86 82.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.758 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -56.16 24.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.953 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.527 ' HB ' HD21 ' C' ' 85' ' ' LEU . 35.7 m -67.62 -33.3 61.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.354 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.63 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -59.66 -38.04 80.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -67.11 -32.6 73.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.355 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.84 -46.76 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -59.84 -41.45 91.39 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.702 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 59.7 mtm -68.51 -39.32 81.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.787 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.5 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.0 t80 -63.07 -44.84 94.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.718 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.27 -44.99 95.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.397 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 57.8 m -58.73 -41.98 87.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.865 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.43 -47.41 76.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.914 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -59.04 -40.93 86.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.866 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 42.2 t -57.96 -50.23 78.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.625 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.423 ' HD2' HH11 ' C' ' 64' ' ' ARG . 10.7 mmt85 -72.07 -38.82 69.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.949 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.451 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 79.2 t80 -58.03 -42.37 85.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.111 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.47 19.94 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.005 0.431 . . . . 10.0 111.513 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -128.4 -44.66 1.38 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.803 0.335 . . . . 10.0 111.543 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.98 -38.67 0.27 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.956 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.521 ' O ' HG12 ' C' ' 72' ' ' ILE . 0.7 OUTLIER -79.68 41.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.868 0.322 . . . . 10.0 111.868 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.66 -18.96 33.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.329 0.585 . . . . 10.0 110.247 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -73.0 -14.62 61.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.952 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.555 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 17.1 pt -101.03 160.45 26.64 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.555 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 65.1 Cg_endo -73.93 175.27 11.05 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.318 2.012 . . . . 10.0 113.015 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.41 172.52 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.485 -0.78 . . . . 10.0 109.508 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -49.66 126.36 17.82 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 122.457 0.303 . . . . 10.0 110.528 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.28 122.77 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.295 2.664 . . . . 10.0 113.029 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.768 HG22 ' HA ' ' A' ' 16' ' ' LEU . 5.7 pt -76.58 59.77 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.752 -0.658 . . . . 10.0 112.341 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.714 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -112.96 -59.12 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.714 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 12.0 Cg_exo -71.56 106.84 2.04 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.159 1.906 . . . . 10.0 111.682 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.812 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 2.3 pt-20 -73.46 50.69 0.32 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.049 -0.523 . . . . 10.0 112.372 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -110.17 19.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.71 0.767 . . . . 10.0 109.862 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.5 -42.43 18.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.062 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.35 -30.17 70.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.208 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 13.1 mp0 -59.7 -41.67 91.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.998 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.549 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.3 mt -78.77 -38.04 39.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.705 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 2.9 tt -61.44 -32.37 72.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.357 -0.838 . . . . 10.0 110.846 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 33.0 ttp -59.6 -19.85 51.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.989 -0.55 . . . . 10.0 112.083 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.46 -32.49 71.44 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.54 -58.89 0.42 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 124.021 0.826 . . . . 10.0 113.223 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -82.04 39.45 0.57 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.164 0.507 . . . . 10.0 111.025 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.678 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.492 -0.243 . . . . 10.0 112.492 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.564 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.69 -66.18 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 -179.082 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 14.2 tp -63.98 -27.26 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.499 -178.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -55.34 -29.7 58.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.601 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -102.25 -40.43 6.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.96 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.611 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.4 mt -57.66 -36.11 71.44 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.498 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.48 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.72 0.295 . . . . 10.0 110.586 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.48 -31.22 70.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.383 0.611 . . . . 10.0 110.127 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.46 -18.18 61.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.819 . . . . 10.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.57 -53.21 4.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.24 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.89 132.62 21.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 111.593 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.2 mt -88.97 114.46 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 69.5 tttt -116.38 100.47 53.48 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.401 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -89.41 32.9 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.121 2.548 . . . . 10.0 111.826 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -92.23 170.4 9.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.004 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -83.23 160.51 21.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.906 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.6 mm -108.98 153.78 10.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.441 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.032 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.6 OUTLIER -167.18 133.76 1.85 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.88 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 44.3 Cg_exo -39.21 127.64 1.44 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.612 2.874 . . . . 10.0 113.031 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.89 127.5 24.59 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 123.349 2.699 . . . . 10.0 112.297 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -68.14 132.12 91.94 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.519 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.94 -20.58 45.38 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 123.445 2.763 . . . . 10.0 113.745 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -34.13 77.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.782 0.325 . . . . 10.0 111.244 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.557 HG22 ' HG ' ' A' ' 26' ' ' LEU . 24.1 m -128.37 -160.8 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.696 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' C' ' 50' ' ' HIS . 3.8 ptp180 -129.99 51.52 2.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 10.0 110.815 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -149.7 148.0 28.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.602 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' C' ' 84' ' ' GLU . 4.4 pp -72.01 154.27 41.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.909 0.385 . . . . 10.0 111.148 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.0 OUTLIER -92.03 162.42 14.38 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.756 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.2 tt0 -112.02 115.45 28.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.254 -0.276 . . . . 10.0 110.254 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.032 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.9 t70 -156.87 -76.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.865 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.18 -59.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.3 m0 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.359 -0.829 . . . . 10.0 109.857 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmm . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.59 0.233 . . . . 10.0 111.506 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.63 142.14 28.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.568 HG11 HD13 ' B' ' 57' ' ' LEU . 95.6 t -127.8 125.66 65.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.775 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.75 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 55.5 m-85 -113.77 112.35 23.28 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.615 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.62 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.57 158.04 41.08 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.785 0.326 . . . . 10.0 111.06 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.449 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 31.7 mtm -126.24 112.81 16.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.734 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' B' ' 75' ' ' VAL . 46.1 mm -84.32 105.69 13.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -100.85 102.35 13.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 32.3 ttp85 -92.38 65.33 4.51 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.036 -1.468 . . . . 10.0 107.036 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 65.11 -86.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.022 -0.99 . . . . 10.0 111.479 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -95.24 -21.65 18.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.665 0.246 . . . . 10.0 111.665 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -99.58 105.18 17.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.665 0.269 . . . . 10.0 111.684 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 26.4 m -103.18 121.39 42.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.716 0.293 . . . . 10.0 110.236 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.67 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.3 mt -111.08 117.95 56.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.434 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -77.39 113.09 14.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.62 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -106.26 108.27 19.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.325 0.583 . . . . 10.0 111.928 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 1.053 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 2.6 t70 -95.46 106.45 18.52 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.684 -1.228 . . . . 10.0 107.684 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -129.28 -165.85 1.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.548 -0.296 . . . . 10.0 111.286 -178.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -125.32 160.65 28.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.28 -21.87 66.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.91 0.386 . . . . 10.0 111.953 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -16.98 57.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.389 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.6 m -72.99 147.0 45.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.887 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.9 p -96.79 166.13 11.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.922 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.58 -35.17 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.184 0.516 . . . . 10.0 109.705 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -60.58 -37.55 81.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.994 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -65.07 -34.63 78.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.958 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.682 HD11 HD21 ' B' ' 57' ' ' LEU . 89.1 mt -59.93 -45.37 92.83 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.806 -0.442 . . . . 10.0 109.806 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -64.28 -34.03 77.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.539 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -67.26 -33.29 75.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.148 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.407 HD12 ' HA ' ' B' ' 27' ' ' LEU . 64.8 mt -72.14 -46.29 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 88.0 t -64.2 -31.64 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.234 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.7 tt0 -56.36 -43.11 78.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.973 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.26 -19.71 79.45 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 10.0 112.515 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 75.2 mt -87.69 -59.75 2.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 111.845 0.313 . . . . 10.0 111.845 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.6 mt -80.83 -12.67 59.39 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.086 0.402 . . . . 10.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 84.9 mttt 60.17 36.35 21.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.155 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 37' ' ' ARG . 27.3 mtt180 -127.65 144.82 52.5 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.731 -179.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.52 127.68 16.49 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.699 2.933 . . . . 10.0 113.856 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.771 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 52.7 Cg_endo -71.39 -19.76 28.44 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.886 2.391 . . . . 10.0 111.81 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.66 -28.85 68.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.691 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -94.28 0.23 55.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.32 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -84.93 129.03 34.87 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.241 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.516 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.9 mmt-85 -116.7 107.11 14.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.189 -0.459 . . . . 10.0 109.862 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.4 mt -89.63 113.73 25.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.554 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' TYR . . . . . 0.404 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 54.9 m-85 -110.8 113.59 26.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.125 0.488 . . . . 10.0 111.813 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.485 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 37.6 tttm -119.01 128.91 54.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 62.93 37.78 11.71 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.488 0.493 . . . . 10.0 110.947 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 64.36 21.43 12.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.218 -0.901 . . . . 10.0 112.027 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -136.73 155.65 49.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.8 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.7 tp -78.13 141.13 38.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.466 -0.333 . . . . 10.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 mt -84.89 151.82 24.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.076 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.522 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 30.9 t0 -88.72 118.57 28.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.281 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.15 -26.99 68.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 10.0 112.267 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.37 2.69 81.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.074 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 51.1 mttp -109.81 154.97 22.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.231 0.539 . . . . 10.0 111.731 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 36.5 p -86.79 172.21 10.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.501 -0.772 . . . . 10.0 109.59 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.682 HD21 HD11 ' B' ' 27' ' ' LEU . 54.2 mt -63.71 -37.63 88.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.701 0.286 . . . . 10.0 110.399 179.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.83 -33.74 87.83 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.893 -0.67 . . . . 10.0 112.182 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.57 -25.82 45.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.697 0.284 . . . . 10.0 111.525 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.9 m -89.41 0.96 56.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.18 64.31 1.66 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.714 -0.755 . . . . 10.0 113.096 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.485 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 24.5 m-85 -124.7 47.37 2.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.857 0.36 . . . . 10.0 110.175 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 79.1 p -68.34 164.02 21.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -17.39 63.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.765 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.84 -30.17 50.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.09 0.471 . . . . 10.0 110.239 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.94 -36.27 12.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.075 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.75 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -108.45 100.22 9.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 109.875 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.41 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 0.3 OUTLIER -115.04 157.0 44.55 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.21 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.87 -14.79 46.26 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.372 2.048 . . . . 10.0 111.33 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.498 ' H ' ' HG3' ' B' ' 70' ' ' GLN . 0.0 OUTLIER -106.78 0.86 24.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.622 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.497 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -164.51 90.29 1.04 Allowed Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.126 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.449 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -76.76 138.07 18.55 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.956 2.437 . . . . 10.0 111.449 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.96 122.88 16.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.666 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.03 122.6 25.16 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.569 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.445 ' HB ' HD13 ' B' ' 7' ' ' ILE . 45.3 t -125.6 129.24 72.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.37 140.85 19.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.785 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -119.86 105.46 11.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.049 0.452 . . . . 10.0 111.885 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.516 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.8 127.96 44.88 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -104.04 117.73 34.98 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.954 -0.298 . . . . 10.0 111.187 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -71.98 97.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.684 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.67 126.53 47.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.188 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.26 134.47 57.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.876 -0.602 . . . . 10.0 112.084 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 67.8 7.58 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.432 -0.804 . . . . 10.0 112.542 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 4.2 m -105.56 98.71 8.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.165 0.507 . . . . 10.0 110.325 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -66.92 -14.23 62.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.098 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -57.12 -32.17 66.07 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.998 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.48 67.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.79 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.7 mt -83.12 -5.25 59.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.521 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 27.2 m -105.28 -14.84 15.22 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.3 mt -104.23 6.29 10.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.155 0.502 . . . . 10.0 111.164 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.404 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 45.5 tt0 -104.52 107.24 57.36 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.173 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.618 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.5 Cg_exo -65.58 -10.66 27.22 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.049 2.5 . . . . 10.0 111.955 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -76.81 -20.68 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.912 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -119.14 -48.42 2.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.954 -0.567 . . . . 10.0 111.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.618 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 20.0 m -115.13 141.47 27.07 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.965 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.44 153.74 75.8 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.526 2.151 . . . . 10.0 111.929 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.19 141.46 94.44 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.046 2.497 . . . . 10.0 112.633 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -72.71 117.61 14.63 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.187 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 31.6 tp -146.32 124.23 6.18 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.486 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.415 ' HG2' ' HE1' ' C' ' 50' ' ' HIS . 22.7 Cg_exo -66.64 136.27 41.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.751 2.301 . . . . 10.0 112.13 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -66.83 -30.91 71.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.397 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.7 m -70.91 -16.04 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.496 0.665 . . . . 10.0 110.243 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.723 ' HA ' HE22 ' B' ' 106' ' ' GLN . 88.1 mmm -124.27 54.49 1.35 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.318 -0.856 . . . . 10.0 108.99 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.529 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 39.9 tttm -132.23 -49.5 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.329 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.529 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 10.3 Cg_exo -73.02 65.57 4.15 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 122.309 2.006 . . . . 10.0 111.958 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.723 HE22 ' HA ' ' B' ' 103' ' ' MET . 1.5 mt-30 -134.72 174.97 9.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.902 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -90.87 176.96 6.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.845 0.355 . . . . 10.0 111.201 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -102.93 135.62 44.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.123 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -88.82 -143.64 9.58 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.046 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.84 -38.47 11.22 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.185 0.516 . . . . 10.0 110.722 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.679 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.3 m -76.75 159.61 30.0 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.761 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 112' ' ' ALA . . . . . 0.497 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.16 121.14 14.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 179.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 72.33 16.92 4.97 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.915 0.759 . . . . 10.0 111.903 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.679 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 27.0 tt0 -71.53 119.98 16.45 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.822 0.344 . . . . 10.0 110.078 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.88 122.48 33.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.834 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.437 ' HB1' HE22 ' B' ' 118' ' ' GLN . . . -106.9 103.28 12.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.883 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.515 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.5 t -90.46 101.38 12.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.52 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.437 HE22 ' HB1' ' B' ' 116' ' ' ALA . 1.7 mp0 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.78 0.324 . . . . 10.0 111.363 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.481 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.2 ttpt -110.87 117.59 33.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.707 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.53 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 31.7 mt -92.61 123.56 36.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.081 -0.509 . . . . 10.0 109.839 179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 mt -107.57 116.98 52.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.8 p -89.04 177.76 6.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.494 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 13.7 m -76.99 2.85 13.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.862 0.363 . . . . 10.0 111.658 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -102.14 3.67 38.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 10.0 110.356 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.56 12.83 84.13 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.649 -0.786 . . . . 10.0 111.398 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.6 133.94 33.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.657 0.265 . . . . 10.0 110.324 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.481 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 21.5 mt-10 -107.18 126.66 52.68 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.071 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.66 108.57 16.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.562 -0.29 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.67 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 9.4 mm -89.79 118.68 35.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.841 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 23.6 t -105.95 135.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 1.053 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 53.7 tttt -59.71 132.04 52.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 110.135 -0.321 . . . . 10.0 110.135 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 11.2 tpt180 -52.06 -37.04 52.39 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.447 0.467 . . . . 10.0 111.21 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.502 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 58.0 tt0 -54.53 -43.22 71.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.537 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -85.27 -33.36 22.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.035 0.445 . . . . 10.0 110.742 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.47 91.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.521 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 89.2 mt -58.39 -48.18 81.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.966 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -39.54 93.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.468 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -64.88 -36.7 85.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.8 -6.7 82.48 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.657 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 19.8 m -91.02 -22.1 20.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.307 0.575 . . . . 10.0 109.71 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -76.6 152.44 5.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.651 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -70.62 80.53 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.175 0.512 . . . . 10.0 110.529 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -97.36 178.15 5.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.678 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 94.3 mmm -78.5 35.39 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.981 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.57 -26.54 66.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.353 0.597 . . . . 10.0 109.606 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 4.3 m -95.54 17.65 14.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.243 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.85 -61.99 3.8 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.573 -0.739 . . . . 10.0 112.673 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.33 -174.8 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.514 2.143 . . . . 10.0 111.901 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.04 -79.21 0.15 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.986 -0.626 . . . . 10.0 112.519 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -122.24 127.71 50.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -88.65 85.17 6.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.317 0.579 . . . . 10.0 111.076 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.11 155.39 32.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.34 -25.43 49.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.996 0.739 . . . . 10.0 112.996 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.11 -39.45 90.02 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.616 -0.512 . . . . 10.0 109.616 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.532 ' O ' HG22 ' C' ' 42' ' ' VAL . 14.9 tp10 -88.84 -13.98 38.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.267 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 6.8 m -78.27 -40.26 37.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 10.0 110.191 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -75.66 -44.43 42.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.179 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -128.63 103.62 7.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.321 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.532 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.9 t -94.8 123.64 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.885 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -101.35 121.03 41.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.877 0.37 . . . . 10.0 110.892 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.562 ' HB3' HD12 ' C' ' 47' ' ' ILE . 95.3 m-85 -101.61 117.31 34.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.956 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 45' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 6.4 mmt180 -92.16 132.79 36.35 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.374 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 46' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 1.4 mp0 75.11 3.81 4.15 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.998 0.811 . . . . 10.0 112.279 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.562 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.1 mt -106.62 109.02 62.85 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.984 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.57 157.68 59.5 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.152 2.568 . . . . 10.0 112.127 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.9 p -64.78 -39.36 93.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.498 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 50' ' ' HIS . . . . . 0.426 ' HB2' ' HD3' ' A' ' 30' ' ' ARG . 6.7 m80 -52.24 -59.07 4.83 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.818 0.673 . . . . 10.0 112.818 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.467 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.7 m -64.93 -35.66 75.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 10.0 111.397 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 -33.97 77.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.804 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 26.1 m -61.92 -43.06 99.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.893 0.378 . . . . 10.0 110.547 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -66.43 -35.6 80.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.311 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' C' ' 51' ' ' VAL . 88.1 t -63.36 -47.55 91.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.09 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 36.0 m -60.29 -42.92 96.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.854 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.3 mtm -67.26 -37.27 83.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.611 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.4 t80 -65.74 -41.95 91.56 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.427 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.409 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.8 m-85 -64.72 -45.7 85.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.104 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 42.9 m -58.69 -42.35 88.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.301 0.572 . . . . 10.0 109.665 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -64.75 -43.7 92.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.143 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -62.79 -40.75 98.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.098 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.409 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.2 t -60.07 -50.48 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.1 mmt180 -68.89 -37.85 79.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.338 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 69.0 t80 -58.2 -48.24 80.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.064 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.13 7.05 23.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.67 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.85 -46.93 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.177 -0.327 . . . . 10.0 111.57 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 6.3 m -146.15 -34.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.555 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.9 m -80.74 42.5 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.296 0.48 . . . . 10.0 112.296 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.06 -7.13 57.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.241 0.543 . . . . 10.0 110.066 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -78.76 -21.54 47.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.636 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 39.7 pt -95.96 163.8 20.17 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.194 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.636 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 80.8 Cg_endo -76.99 -177.31 3.72 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.304 2.003 . . . . 10.0 112.726 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.96 169.9 13.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.009 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -54.16 128.98 58.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.556 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -50.76 129.49 27.5 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.126 2.551 . . . . 10.0 112.834 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 pt -81.65 36.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.568 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -80.08 -59.71 0.53 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.395 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 72.1 Cg_endo -79.74 119.67 4.09 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.764 1.643 . . . . 10.0 110.505 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.35 12.32 1.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 38.4 mm -78.9 75.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.408 0.623 . . . . 10.0 109.952 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -138.92 -43.21 0.47 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.119 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.413 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 13.4 tp -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.644 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.591 ' HA ' HD23 ' A' ' 32' ' ' LEU . 23.9 mp0 -60.5 -37.29 80.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.325 -0.852 . . . . 10.0 109.47 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 8' ' ' LEU . 60.3 mt -79.49 -36.64 38.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.731 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.77 -31.75 73.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.525 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.9 ttp -58.98 -25.2 63.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.915 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.15 -35.49 73.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.05 -55.2 0.56 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.293 0.849 . . . . 10.0 113.293 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -81.97 36.17 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.117 0.484 . . . . 10.0 111.14 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.695 -0.669 . . . . 10.0 109.574 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.637 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.195 -0.362 . . . . 10.0 112.195 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.448 ' CB ' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -68.0 -57.82 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.214 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.828 HD21 ' HB3' ' C' ' 85' ' ' LEU . 23.5 tp -63.12 -27.85 69.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.933 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -55.51 -35.09 65.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.265 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -95.36 -37.33 11.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.329 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 95.0 mt -63.07 -36.85 84.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.385 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.8 88.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.349 . . . . 10.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.3 tp -68.6 -30.03 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.279 0.561 . . . . 10.0 109.547 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.43 -8.89 59.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.52 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.15 -35.69 11.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.171 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.669 ' HA ' HG22 ' C' ' 77' ' ' ILE . 3.7 tp -163.56 122.38 2.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.172 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.0 mt -82.55 92.65 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 79.5 tttt -104.45 107.21 57.16 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.44 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -95.29 52.62 0.2 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.325 2.684 . . . . 10.0 111.173 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 69.1 mttt -108.87 174.82 5.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.874 -179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -80.47 143.02 33.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.739 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -100.24 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.074 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.094 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER -120.88 136.24 25.38 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.416 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.7 Cg_exo -34.5 133.49 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.147 3.231 . . . . 10.0 113.624 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.695 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 29.2 Cg_endo -62.98 138.23 66.78 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.0 2.467 . . . . 10.0 112.442 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -71.48 125.76 91.76 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.376 179.38 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -61.13 -22.33 74.35 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.224 2.616 . . . . 10.0 113.198 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -35.89 82.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.051 0.453 . . . . 10.0 111.074 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 t -120.07 -132.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.86 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.0 ptp180 -158.98 52.66 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.112 0.482 . . . . 10.0 111.258 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 14.9 tttm -149.57 148.44 29.36 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.695 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.65 148.9 44.35 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.83 0.347 . . . . 10.0 110.681 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -91.4 172.93 8.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.075 -179.108 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.457 ' H ' HG22 ' A' ' 33' ' ' THR . 6.7 mt-10 -117.16 113.59 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.399 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.094 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.4 t70 -156.57 -81.64 0.07 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 -62.62 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.9 m0 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.54 179.654 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 mmm . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.949 0.404 . . . . 10.0 110.801 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.77 122.95 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.922 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.415 HG11 HD13 ' B' ' 57' ' ' LEU . 93.3 t -123.65 116.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.107 0.48 . . . . 10.0 111.095 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.47 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 44.7 m-85 -105.08 110.97 23.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.551 -0.75 . . . . 10.0 109.473 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.67 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -124.56 154.63 40.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.991 0.425 . . . . 10.0 111.646 -179.289 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.596 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 53.9 mtm -122.77 104.87 9.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.334 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.496 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.4 mm -78.2 107.25 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.912 -0.773 . . . . 10.0 108.912 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -109.95 104.4 13.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.866 0.691 . . . . 10.0 112.866 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.456 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 27.8 ttp85 -89.03 67.43 8.1 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.595 -1.261 . . . . 10.0 107.595 177.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.549 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.1 t-160 67.77 -76.69 0.05 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.174 -0.921 . . . . 10.0 111.485 -178.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.407 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 72.3 mmtt -110.01 -9.35 14.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.483 -0.326 . . . . 10.0 111.382 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.8 m -105.2 99.59 9.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.062 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.2 m -101.17 125.53 47.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.923 0.392 . . . . 10.0 111.019 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 40.2 mt -121.52 121.85 65.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.313 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' PHE . . . . . 0.47 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 62.3 t80 -79.6 121.69 25.58 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.67 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.0 m -114.7 119.82 38.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.089 0.471 . . . . 10.0 111.452 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.678 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.9 t70 -103.31 103.68 13.72 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.207 -1.034 . . . . 10.0 108.207 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ALA . . . . . 0.466 ' O ' ' HD3' ' B' ' 19' ' ' LYS . . . -130.64 -166.66 1.72 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.653 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.466 ' HD3' ' O ' ' B' ' 18' ' ' ALA . 20.7 mmtt -128.88 165.5 20.92 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.754 -0.462 . . . . 10.0 109.754 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.401 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 16.9 mp0 -61.52 -28.46 69.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.649 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 m -69.13 -21.49 64.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.85 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 2.3 m -73.75 145.23 45.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.743 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.5 p -94.34 162.97 13.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.761 0.315 . . . . 10.0 111.033 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.517 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 97.4 t -64.89 -34.03 67.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.133 0.492 . . . . 10.0 109.992 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -62.56 -34.99 78.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.406 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -68.24 -33.37 74.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.906 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.77 HD11 HD21 ' B' ' 57' ' ' LEU . 87.1 mt -62.15 -43.71 98.24 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.735 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.1 mttt -62.23 -33.81 75.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.237 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtp180 -66.2 -40.44 90.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.512 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.61 -46.8 91.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.835 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.98 -36.84 77.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.673 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.628 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.4 tm-20 -56.5 -43.39 79.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.34 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.88 -18.02 78.74 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -94.08 -57.29 4.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.774 0.321 . . . . 10.0 111.528 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.588 HD21 HG21 ' B' ' 12' ' ' THR . 22.1 mt -76.87 -14.19 59.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.3 mttt 64.75 31.61 11.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.373 0.606 . . . . 10.0 110.994 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.402 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 62.8 mtt-85 -123.42 135.08 25.67 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.856 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 74.7 Cg_exo -53.07 138.82 62.61 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 123.384 2.723 . . . . 10.0 113.028 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.735 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 13.9 Cg_exo -70.82 -12.53 31.03 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.831 2.354 . . . . 10.0 111.19 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.15 -45.66 75.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.204 -0.907 . . . . 10.0 112.134 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -99.83 16.76 22.68 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -88.04 123.45 32.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.816 0.341 . . . . 10.0 110.849 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' B' ' 43' ' ' ARG . 39.7 mmt-85 -116.1 111.86 20.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.11 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -96.01 120.39 36.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.402 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -113.75 127.8 56.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.496 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.0 tttm -135.49 137.26 41.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 48' ' ' ASP . 4.7 m-20 62.44 25.26 15.06 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.347 0.405 . . . . 10.0 110.379 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 47' ' ' ASP . 78.6 m-20 75.18 4.32 4.16 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.404 -0.816 . . . . 10.0 112.239 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -119.54 163.11 17.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.069 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.0 tp -79.97 141.14 36.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.544 0.211 . . . . 10.0 110.689 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -80.37 155.58 27.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.318 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -98.92 115.37 28.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.859 0.361 . . . . 10.0 111.199 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.517 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 78.4 m-20 -60.33 -29.37 68.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.639 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 3.84 75.88 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.003 -0.617 . . . . 10.0 113.485 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -118.02 163.53 16.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.066 0.46 . . . . 10.0 111.017 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.5 p -92.25 170.44 9.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.896 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.77 HD21 HD11 ' B' ' 27' ' ' LEU . 34.7 mt -62.26 -41.91 98.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.904 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.73 -40.58 95.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.09 -0.576 . . . . 10.0 112.512 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -72.27 -21.16 61.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 10.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 70.2 m -89.47 3.17 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.009 0.433 . . . . 10.0 111.646 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.61 2.72 63.1 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.724 -0.751 . . . . 10.0 113.293 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.496 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 57.5 m-85 -75.77 96.85 3.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.05 0.425 . . . . 10.0 110.171 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 55.1 p -114.94 164.55 13.98 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 20.0 m -72.52 -2.45 19.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.304 0.573 . . . . 10.0 110.476 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -90.17 -49.42 6.57 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.642 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -35.02 55.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.043 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.11 103.69 12.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.526 ' HB3' ' HG3' ' B' ' 70' ' ' GLN . 16.3 mtm180 -119.31 163.07 28.81 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.731 -178.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.409 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 32.8 Cg_endo -66.78 -14.88 45.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.043 1.829 . . . . 10.0 110.531 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -103.76 -1.62 27.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.169 -0.923 . . . . 10.0 110.104 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.729 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.63 84.17 1.35 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.438 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.9 Cg_exo -76.87 136.41 16.68 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.855 2.37 . . . . 10.0 111.837 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 122.19 17.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.418 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -80.81 124.69 29.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.948 0.404 . . . . 10.0 111.448 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.496 ' HB ' HD13 ' B' ' 7' ' ' ILE . 39.6 t -117.87 125.92 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.95 126.85 7.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.768 -0.73 . . . . 10.0 111.91 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.54 111.17 22.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.719 0.295 . . . . 10.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -107.29 128.91 54.87 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.669 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -105.04 116.58 32.19 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.229 -0.285 . . . . 10.0 110.229 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -76.75 85.5 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.581 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -96.72 131.42 43.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.77 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.79 140.22 58.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.28 7.4 4.87 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.982 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.8 m -117.87 104.59 11.08 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -76.68 0.36 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 10.0 112.061 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.1 tt0 -57.12 -32.22 66.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.04 0.448 . . . . 10.0 110.657 179.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.23 -26.24 67.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.747 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.8 mt -75.66 -26.29 57.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.831 0.348 . . . . 10.0 111.005 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 22.4 m -83.61 -32.32 25.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' B' ' 10' ' ' HIS . 17.6 mt -81.78 -27.09 9.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.388 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -70.01 110.51 6.8 Favored Pre-proline 0 C--O 1.234 0.284 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.314 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.617 ' HA ' ' O ' ' B' ' 95' ' ' SER . 15.4 Cg_exo -69.88 -8.89 24.74 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.544 2.829 . . . . 10.0 112.531 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.842 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.9 m -99.0 -44.68 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.236 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.617 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 13.0 m -107.48 144.35 29.05 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.067 -179.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 159.84 47.42 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.595 2.197 . . . . 10.0 111.576 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.22 128.07 21.79 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.559 2.172 . . . . 10.0 111.473 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.76 106.84 3.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.101 0.476 . . . . 10.0 111.668 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 35.1 tp -129.78 120.71 19.65 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.188 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -51.43 120.31 6.73 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.755 2.303 . . . . 10.0 111.761 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.01 -33.7 71.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.427 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.14 -15.32 18.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.808 0.337 . . . . 10.0 111.347 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 67.5 mmm -115.22 21.28 14.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.412 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.447 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 50.3 tttm -96.41 -51.08 0.23 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 113.565 0.95 . . . . 10.0 113.565 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.447 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 56.5 Cg_endo -71.62 82.87 1.12 Allowed 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.145 1.897 . . . . 10.0 112.743 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -161.03 -171.69 3.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.689 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.49 ' HB2' HE22 ' B' ' 118' ' ' GLN . 5.5 t0 -104.83 174.99 5.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.916 0.389 . . . . 10.0 111.215 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -100.99 157.12 16.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.49 -129.99 5.1 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.678 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 10.5 m -110.93 -31.09 7.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.093 0.473 . . . . 10.0 110.024 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.729 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 51.0 m -86.53 170.76 11.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.932 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.47 134.04 36.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.1 t30 70.59 7.38 6.19 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.555 0.535 . . . . 10.0 111.032 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 50.7 tt0 -84.9 121.06 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -108.87 151.78 25.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.741 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -128.81 103.81 7.27 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.477 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.586 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.1 t -67.7 134.29 30.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' B' ' 107' ' ' ASP . 12.6 mp0 . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.183 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.061 0.457 . . . . 10.0 110.841 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -105.25 115.86 30.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.452 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.474 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 25.2 mt -90.63 133.29 35.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.882 -0.784 . . . . 10.0 108.882 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 13.3 mt -118.6 113.63 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.762 -0.199 . . . . 10.0 110.691 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.15 161.33 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -20.98 64.78 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.256 0.465 . . . . 10.0 112.256 -179.418 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -74.15 -10.48 59.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.704 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.16 39.25 8.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.595 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -111.73 140.95 45.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.719 0.295 . . . . 10.0 110.265 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.611 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.3 mt-10 -99.86 128.64 45.94 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.495 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 65.6 m-85 -127.69 96.73 4.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.95 0.405 . . . . 10.0 110.531 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.55 116.48 34.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.001 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.5 t -100.54 141.5 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.823 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.678 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 75.3 tttt -55.98 130.09 42.44 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.169 0.293 . . . . 10.0 110.237 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.649 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 63.4 ttt180 -54.6 -34.8 62.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.702 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -56.49 -46.85 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.154 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -74.65 -31.95 62.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.15 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.44 68.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.909 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 55.4 mt -58.75 -56.82 17.3 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.151 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -65.9 -31.39 72.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.716 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 43.9 m -65.32 -33.27 75.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 10.0 109.922 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.17 -12.82 82.8 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.128 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.09 -12.5 57.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.389 0.614 . . . . 10.0 110.029 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 45.5 mt -90.71 146.69 5.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.813 -0.81 . . . . 10.0 108.813 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.33 76.52 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.438 0.637 . . . . 10.0 111.102 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' SER . . . -85.55 -174.21 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.094 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.637 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.7 mmm -79.12 37.36 0.31 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mp -69.8 -32.64 71.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.16 13.96 19.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.17 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 30' ' ' GLY . . . . . 0.428 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -75.97 -56.3 4.5 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.633 -0.712 . . . . 10.0 113.109 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 31' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 42.0 Cg_endo -66.73 179.63 2.09 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.661 2.241 . . . . 10.0 112.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.28 -46.77 14.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.698 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -141.76 104.68 4.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.766 0.317 . . . . 10.0 110.606 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -87.02 89.61 8.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.98 0.419 . . . . 10.0 110.602 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.98 174.91 8.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.569 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.23 -25.85 68.25 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.673 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -58.98 -43.28 91.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.054 0.454 . . . . 10.0 109.779 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.7 mp0 -75.34 -18.49 59.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.822 179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.9 m -78.57 -30.32 46.75 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -81.68 -50.88 8.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.661 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.18 107.13 9.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.8 t -94.55 103.77 15.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.455 -179.263 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -89.39 122.68 32.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.036 0.446 . . . . 10.0 111.053 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.702 ' HB3' HD12 ' C' ' 47' ' ' ILE . 86.5 m-85 -103.62 144.03 31.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.632 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -113.65 132.52 55.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.507 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 61.02 28.94 18.68 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.694 0.621 . . . . 10.0 112.663 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.702 HD12 ' HB3' ' C' ' 44' ' ' PHE . 83.7 mt -121.82 103.08 40.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.587 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.447 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 48.7 Cg_exo -57.5 140.28 92.77 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.092 2.528 . . . . 10.0 113.097 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -59.61 -36.1 75.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.278 -0.873 . . . . 10.0 111.093 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -51.22 70.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.43 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.1 m -70.85 -29.21 36.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.95 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 tp -66.37 -36.91 84.08 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -61.98 -33.94 75.24 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.139 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 13.4 tptp -65.42 -39.93 92.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.571 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -67.24 -46.52 83.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.933 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 76.5 m -58.21 -42.87 87.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.428 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.2 mtm -64.9 -39.52 93.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.815 0.34 . . . . 10.0 110.884 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -67.48 -39.06 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.379 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -64.22 -46.5 83.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.06 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 31.5 m -59.19 -42.1 90.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.374 0.607 . . . . 10.0 109.782 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.409 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 14.5 t80 -66.56 -43.48 84.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.39 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -63.62 -38.77 92.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.492 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.35 -47.44 92.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.986 0.422 . . . . 10.0 110.253 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.867 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 16.3 t80 -58.21 -45.08 88.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.639 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -87.31 21.54 2.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.202 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -131.4 -47.82 0.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.085 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.22 -39.87 0.4 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.011 0.375 . . . . 10.0 112.011 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.57 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -76.53 39.67 0.21 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.04 -11.03 45.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.126 0.488 . . . . 10.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -92.57 4.82 52.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.42 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 pt -118.25 156.38 50.76 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.186 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.69 159.72 16.43 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.2 2.6 . . . . 10.0 112.999 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 13.4 tp10 -69.09 171.08 8.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.215 -0.902 . . . . 10.0 109.597 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.411 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 36.4 t80 -47.91 130.76 11.76 Favored Pre-proline 0 C--O 1.233 0.19 0 O-C-N 123.291 0.369 . . . . 10.0 110.923 179.57 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -53.09 111.8 0.76 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.078 2.519 . . . . 10.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.1 pt -76.75 61.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.371 0.605 . . . . 10.0 111.18 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -114.67 -53.3 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.587 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 24.8 Cg_exo -64.11 119.72 6.85 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.948 1.765 . . . . 10.0 111.486 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.78 -14.58 46.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.404 0.52 . . . . 10.0 112.404 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -79.62 98.67 3.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.046 0.451 . . . . 10.0 110.471 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.08 -43.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.648 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.466 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.9 tp -67.18 -24.28 65.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.551 ' HA ' HD23 ' A' ' 32' ' ' LEU . 32.9 mp0 -62.88 -29.65 70.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.985 -1.007 . . . . 10.0 109.779 178.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.828 ' HB3' HD21 ' A' ' 8' ' ' LEU . 50.1 mt -77.01 -32.45 57.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.452 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -21.41 63.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.984 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.0 ttp -66.1 -18.74 65.54 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.663 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.95 -33.18 75.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.776 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.72 -61.28 0.37 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.985 0.803 . . . . 10.0 112.933 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -82.65 45.95 1.03 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.903 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.598 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.7 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.097 -0.705 . . . . 10.0 109.097 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 112.145 -0.382 . . . . 10.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.443 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.23 -55.9 18.39 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -60.37 -30.47 69.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -178.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.69 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 31.1 mt-30 -58.12 -32.68 68.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 10.0 111.042 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -96.95 -40.8 8.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.001 0.429 . . . . 10.0 110.426 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.519 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.9 mt -60.27 -42.7 95.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.16 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.23 64.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.727 0.298 . . . . 10.0 111.082 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.2 tp -63.83 -40.06 95.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.023 0.44 . . . . 10.0 110.422 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -14.15 59.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.955 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.9 -24.16 20.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.776 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 2.7 tp -164.54 110.37 1.0 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 10.0 111.835 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.2 mt -84.31 88.02 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.625 ' HB3' HD22 ' C' ' 83' ' ' LEU . 83.7 tttt -96.1 106.65 29.83 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.836 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 3.4 Cg_endo -88.23 60.32 3.02 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.546 2.831 . . . . 10.0 112.092 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -126.91 167.28 16.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -79.32 151.97 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.24 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.631 HD11 HD23 ' C' ' 83' ' ' LEU . 48.2 mm -113.47 100.02 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.906 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 36.6 tttp -107.63 138.26 19.94 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.41 133.12 0.16 Allowed 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.756 2.97 . . . . 10.0 113.422 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.916 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.0 Cg_endo -53.42 151.85 22.26 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.898 3.065 . . . . 10.0 114.281 -178.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mp -81.07 122.36 81.59 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.641 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -59.19 -26.21 80.91 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.274 2.649 . . . . 10.0 113.091 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -35.96 78.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.62 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.431 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 4.3 m -118.59 -145.53 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.763 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 2.5 ptp180 -143.29 53.8 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.381 0.61 . . . . 10.0 110.634 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.6 tttm -150.38 150.28 31.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.026 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.916 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -76.04 156.12 34.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 10.0 110.806 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.58 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -90.05 152.11 21.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.668 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -107.35 106.16 16.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.861 0.362 . . . . 10.0 110.509 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.906 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 t70 -164.36 -72.58 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.114 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.28 -69.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.143 -0.932 . . . . 10.0 109.4 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.855 0.359 . . . . 10.0 110.508 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.12 136.15 39.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.824 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.41 HG11 HD13 ' B' ' 57' ' ' LEU . 52.6 t -124.97 124.46 67.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.165 0.507 . . . . 10.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.46 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.9 m-85 -113.74 111.7 22.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.735 179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.738 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -126.32 156.15 40.88 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.962 0.411 . . . . 10.0 111.66 -179.779 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.651 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 67.3 mtm -124.2 107.77 11.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.313 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.55 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -80.56 109.45 15.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -105.74 105.89 16.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.162 0.431 . . . . 10.0 112.162 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.513 ' HB2' HD23 ' B' ' 77' ' ' LEU . 10.0 ttp85 -104.6 95.42 5.9 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 177.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 66.13 -88.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.622 0.577 . . . . 10.0 109.691 -178.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -129.16 11.4 5.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.321 0.581 . . . . 10.0 110.434 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 4.2 m -106.45 99.08 8.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.293 178.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' B' ' 7' ' ' ILE . 30.9 m -100.68 126.29 47.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.903 0.382 . . . . 10.0 111.083 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.626 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.7 mt -114.66 119.64 62.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.581 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -76.91 117.42 18.5 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.311 -0.625 . . . . 10.0 109.311 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.738 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -112.23 109.82 19.72 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.815 0.672 . . . . 10.0 112.815 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.589 ' HB3' ' CD ' ' C' ' 14' ' ' LYS . 3.7 t70 -97.05 106.87 19.29 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.322 -1.362 . . . . 10.0 107.322 177.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.31 -168.86 2.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.905 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -124.89 161.02 27.48 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' B' ' 56' ' ' THR . 49.6 mt-10 -59.67 -27.1 66.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 10.0 111.74 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.56 -17.79 63.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.695 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.9 m -78.39 134.7 37.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.878 0.371 . . . . 10.0 110.781 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.1 p -85.13 167.26 15.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.197 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.85 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 93.3 t -63.39 -35.82 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 10.0 110.761 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 55.8 t80 -65.33 -33.34 75.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.638 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -65.74 -30.03 70.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.83 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.948 HD11 HD21 ' B' ' 57' ' ' LEU . 64.0 mt -66.8 -42.78 85.39 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.804 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.8 mttt -62.23 -31.57 72.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.212 -0.904 . . . . 10.0 110.526 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -64.59 -41.3 96.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.769 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.69 -43.4 93.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.96 -35.52 73.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.154 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.545 ' HB2' ' HG3' ' B' ' 39' ' ' PRO . 24.4 tt0 -60.97 -41.11 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.02 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.93 -20.88 79.71 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.04 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.9 mt -93.77 -49.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 23.8 mt -84.58 -14.84 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.334 0.494 . . . . 10.0 112.334 -178.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 63.74 32.02 13.92 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.12 0.486 . . . . 10.0 111.696 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -126.35 146.27 55.72 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.866 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.527 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 51.0 Cg_exo -56.71 133.01 55.28 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.418 2.745 . . . . 10.0 113.554 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.804 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 17.2 Cg_exo -70.3 -17.35 35.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.539 2.826 . . . . 10.0 112.165 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -65.51 -31.57 72.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.572 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.478 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 31.8 mm-40 -90.94 -1.72 57.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.644 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -89.28 126.34 35.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.37 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.511 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 21.9 mmt180 -116.41 113.63 23.13 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 48.4 mt -92.31 114.76 27.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.859 0.361 . . . . 10.0 111.18 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -110.65 115.75 30.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.795 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.613 ' HB3' HD21 ' B' ' 51' ' ' LEU . 13.4 tmtt? -129.09 135.96 49.6 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.259 -1.015 . . . . 10.0 108.259 179.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 65.61 32.67 9.06 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.48 0.488 . . . . 10.0 110.627 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.73 13.9 9.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.523 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -135.01 165.9 24.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.729 0.299 . . . . 10.0 110.73 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 tp -82.58 140.43 33.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.583 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.613 HD21 ' HB3' ' B' ' 46' ' ' LYS . 94.3 mt -87.87 146.25 25.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -88.43 113.76 24.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.64 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.85 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 90.4 m-20 -56.96 -29.68 63.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.125 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -76.49 -6.2 83.8 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.592 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -108.77 161.47 15.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.006 0.403 . . . . 10.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -87.4 169.4 12.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.5 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.948 HD21 HD11 ' B' ' 27' ' ' LEU . 51.5 mt -60.4 -43.5 96.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.189 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -55.27 -45.32 83.33 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.132 -0.556 . . . . 10.0 112.741 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -66.08 -28.93 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.111 0.412 . . . . 10.0 112.111 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' CYS . . . . . 0.442 ' HB3' HD22 ' B' ' 51' ' ' LEU . 56.4 m -83.79 11.14 7.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 10.0 112.101 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.87 49.12 7.27 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.763 -0.732 . . . . 10.0 112.777 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 36.6 m-85 -118.48 57.18 0.86 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.169 0.509 . . . . 10.0 110.317 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 14.3 p -76.71 161.6 28.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.728 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.2 p -64.55 -20.04 65.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.489 . . . . 10.0 111.952 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -78.32 -26.98 47.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.778 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -46.04 9.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.065 0.46 . . . . 10.0 109.869 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.46 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -104.1 105.49 15.68 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.54 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.458 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 68.1 mtt180 -116.39 161.13 33.15 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.222 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.584 ' HB3' ' HG3' ' C' ' 64' ' ' ARG . 27.5 Cg_endo -64.58 -19.07 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.219 1.946 . . . . 10.0 110.602 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.57 6.35 34.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.023 -0.989 . . . . 10.0 110.471 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.533 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -167.52 85.6 0.78 Allowed Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.925 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.651 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.7 Cg_exo -77.93 147.63 24.29 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.916 2.411 . . . . 10.0 111.669 179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.76 117.79 22.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.09 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 130.39 39.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.031 0.443 . . . . 10.0 111.622 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.55 ' HB ' HD13 ' B' ' 7' ' ' ILE . 43.9 t -124.36 132.41 71.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.05 129.37 9.03 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.846 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.513 HD23 ' HB2' ' B' ' 9' ' ' ARG . 39.3 tp -110.35 102.14 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.981 0.42 . . . . 10.0 111.962 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.511 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.12 132.61 37.1 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.372 -0.973 . . . . 10.0 108.372 178.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.478 ' CE1' ' HB2' ' B' ' 41' ' ' GLU . 52.1 t80 -117.07 119.1 34.22 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.848 -0.341 . . . . 10.0 111.398 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -70.76 117.52 12.38 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.997 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -131.23 149.96 52.35 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.395 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -76.58 126.13 30.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.665 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.87 -35.95 0.32 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.77 0.669 . . . . 10.0 112.567 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 0.2 OUTLIER -74.8 94.63 2.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.869 0.366 . . . . 10.0 110.199 179.185 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -79.24 16.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.909 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.47 ' O ' HG13 ' B' ' 90' ' ' ILE . 34.5 tt0 -61.33 -25.81 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.696 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.48 67.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.699 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.37 -41.62 98.77 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -79.19 -7.85 58.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.47 HG13 ' O ' ' B' ' 86' ' ' GLU . 8.0 mt -106.25 -0.52 9.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.481 0.658 . . . . 10.0 110.035 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.84 106.71 45.59 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.599 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.4 Cg_exo -65.83 -12.27 34.52 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.164 2.576 . . . . 10.0 112.146 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -76.6 -25.17 53.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.619 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -116.48 -32.77 5.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.599 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.0 m -125.03 146.97 55.36 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.483 0.183 . . . . 10.0 110.971 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.07 153.57 57.45 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 122.413 2.075 . . . . 10.0 111.539 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.61 133.67 40.69 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.715 2.276 . . . . 10.0 112.466 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.62 123.8 24.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.436 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.481 HD12 ' HD2' ' B' ' 100' ' ' PRO . 22.9 tp -147.25 128.76 7.31 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.408 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.481 ' HD2' HD12 ' B' ' 99' ' ' LEU . 10.9 Cg_endo -55.64 124.14 15.56 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.702 2.268 . . . . 10.0 111.564 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.86 -28.68 69.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.29 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.0 m -68.96 -12.49 16.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.147 0.499 . . . . 10.0 110.811 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.467 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 81.4 mmm -120.89 22.34 11.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.773 -0.648 . . . . 10.0 109.734 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -91.48 -51.18 0.31 Allowed Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.5 68.41 6.16 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.349 2.032 . . . . 10.0 112.244 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.467 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 61.4 mt-30 -132.48 -177.71 4.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.37 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' B' ' 118' ' ' GLN . 2.4 t0 -96.81 169.46 9.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.515 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 135.02 37.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.74 -147.67 7.94 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.972 -0.632 . . . . 10.0 113.372 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -99.27 -26.88 14.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.934 0.397 . . . . 10.0 110.89 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.437 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 21.0 m -91.41 163.92 14.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.269 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 112' ' ' ALA . . . . . 0.533 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.45 125.36 25.88 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.676 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.3 t30 70.0 16.01 7.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.508 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 3.1 tt0 -81.3 135.35 35.7 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.98 138.4 52.2 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.098 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.53 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -116.54 116.31 27.38 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.616 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.557 ' H ' HD11 ' C' ' 81' ' ' ILE . 1.7 t -77.86 143.45 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.151 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.473 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 24.8 mp0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.731 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.983 0.421 . . . . 10.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.706 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 37.0 ttpt -115.12 128.37 56.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.132 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.665 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 34.2 mt -96.37 125.11 40.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.842 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -102.02 117.41 47.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.637 0.256 . . . . 10.0 110.597 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -86.86 161.33 18.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.837 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.47 -24.67 67.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.316 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.31 8.66 8.6 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.694 0.283 . . . . 10.0 111.176 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.05 43.82 25.47 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 110.774 -0.93 . . . . 10.0 110.774 -179.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -113.53 141.48 47.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.264 . . . . 10.0 110.451 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.706 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 37.2 mt-10 -112.27 131.43 55.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.236 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' C' ' 2' ' ' LYS . 38.5 m-85 -124.1 104.73 9.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.652 179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.626 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 8.9 mm -87.16 115.08 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -101.13 129.39 52.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 110.092 -0.336 . . . . 10.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.589 ' CD ' ' HB3' ' B' ' 17' ' ' ASP . 77.3 tttt -59.47 128.33 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.613 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 44.6 ttt180 -50.74 -35.96 34.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.47 0.545 . . . . 10.0 112.47 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -50.45 -46.67 56.78 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.333 0.396 . . . . 10.0 111.735 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -85.83 -27.71 24.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.164 0.507 . . . . 10.0 110.717 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 18' ' ' ALA . . . . . 0.426 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -66.41 -29.26 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 96.0 mt -63.5 -49.04 75.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 10.0 110.215 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.596 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -66.18 -40.22 90.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.622 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 18.9 m -63.5 -35.34 80.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.081 0.467 . . . . 10.0 110.459 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.64 -5.0 85.87 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.068 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 10.1 m -89.22 -27.23 20.76 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.359 0.6 . . . . 10.0 109.81 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 12.6 mt -75.65 153.3 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.678 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.11 85.34 1.03 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.089 0.471 . . . . 10.0 110.433 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.443 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -97.32 177.45 5.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.066 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.9 mmm -80.71 35.31 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.151 0.426 . . . . 10.0 112.151 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mp -69.06 -28.74 66.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.246 0.546 . . . . 10.0 109.9 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.37 14.33 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.05 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 30' ' ' GLY . . . . . 0.424 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -74.78 -58.99 3.88 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.749 -0.66 . . . . 10.0 112.84 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 31' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 29.0 Cg_endo -62.95 166.16 14.84 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.556 2.17 . . . . 10.0 112.246 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -49.1 79.0 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.831 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -147.57 115.04 6.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.698 0.285 . . . . 10.0 110.564 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -85.03 91.46 8.09 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.867 -0.419 . . . . 10.0 109.867 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.6 166.69 23.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.575 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.13 -32.12 73.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.619 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -63.94 -38.28 90.49 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.563 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.1 tp10 -72.24 -24.32 61.36 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.91 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -74.96 -30.38 61.19 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -84.32 -52.96 5.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.26 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.535 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 50.5 mt-10 -124.94 100.36 6.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.904 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.563 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -85.01 114.93 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.986 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -93.17 114.74 27.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.96 0.41 . . . . 10.0 111.117 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.665 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 71.9 m-85 -93.68 151.93 19.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.881 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -125.05 130.44 52.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.829 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 69.74 8.54 6.77 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.815 -0.63 . . . . 10.0 112.083 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.469 ' HA ' ' HD3' ' C' ' 48' ' ' PRO . 61.4 mt -105.44 114.58 63.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.692 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 11.8 Cg_exo -73.06 142.78 34.99 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.931 2.421 . . . . 10.0 111.708 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.7 p -60.9 -33.37 73.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.66 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -51.9 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.936 -0.574 . . . . 10.0 111.667 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.58 ' HB ' HD21 ' C' ' 85' ' ' LEU . 26.7 m -78.67 -27.65 14.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.721 0.296 . . . . 10.0 111.268 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 40.3 tp -65.79 -32.88 74.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.074 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 84.5 p -61.28 -39.3 89.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.637 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -65.93 -32.83 74.55 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.655 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.07 -47.64 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 10.9 m -62.93 -40.07 96.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.797 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 54.8 ttm -63.26 -45.74 90.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.252 -0.885 . . . . 10.0 110.431 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.519 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.4 t80 -63.52 -41.76 98.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.45 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.1 m-85 -61.88 -45.07 95.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.379 179.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 51.4 m -59.98 -42.12 93.49 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.304 0.574 . . . . 10.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.51 -41.63 96.3 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.404 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 tptt -63.11 -39.27 94.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.18 -0.464 . . . . 10.0 111.042 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.596 HG22 ' HB ' ' C' ' 20' ' ' THR . 71.1 t -59.2 -48.42 86.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.126 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.584 ' HG3' ' HB3' ' B' ' 69' ' ' PRO . 13.4 mmt180 -70.7 -41.01 72.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.157 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.694 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 78.4 t80 -57.61 -43.74 84.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.257 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 24.99 2.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.144 0.497 . . . . 10.0 111.267 -179.433 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -135.53 -58.52 0.78 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.627 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.39 -28.8 2.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.322 0.49 . . . . 10.0 112.322 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.694 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.2 m -86.93 32.93 0.66 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.37 5.48 20.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 10.0 111.048 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -103.69 -3.38 25.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.963 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.765 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.0 pt -111.36 167.23 9.37 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.118 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.765 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.1 Cg_endo -72.74 170.86 18.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.39 2.06 . . . . 10.0 113.08 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.7 tp10 -70.01 168.15 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.565 -0.743 . . . . 10.0 109.609 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.466 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 38.4 t80 -51.64 134.61 35.39 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 123.202 0.314 . . . . 10.0 110.647 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.7 121.52 8.12 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.067 2.511 . . . . 10.0 112.718 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 26.6 pt -84.25 44.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.799 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -101.64 -53.94 0.14 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 112.768 0.655 . . . . 10.0 112.768 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 21.4 Cg_exo -66.96 112.71 2.56 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.087 1.858 . . . . 10.0 112.598 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.487 ' HA ' HD21 ' A' ' 16' ' ' LEU . 45.1 mt-10 -75.07 55.48 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.335 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 81' ' ' ILE . . . . . 0.557 HD11 ' H ' ' B' ' 117' ' ' VAL . 13.2 mm -120.36 -11.7 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 10.0 111.253 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.776 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.11 -40.36 82.57 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.631 HD23 HD11 ' A' ' 22' ' ' ILE . 6.5 tp -67.44 -30.73 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 10.0 110.282 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.437 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 9.4 mp0 -62.33 -35.95 80.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.877 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.758 ' HB3' HD21 ' A' ' 8' ' ' LEU . 75.2 mt -76.39 -31.58 58.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.845 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.9 tt -64.71 -27.49 68.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.351 -0.841 . . . . 10.0 110.614 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 87' ' ' MET . . . . . 0.517 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 19.8 ttp -60.51 -19.18 56.14 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.904 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.94 -34.19 74.33 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.689 -0.232 . . . . 10.0 111.106 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.69 -57.64 0.5 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.208 0.818 . . . . 10.0 113.208 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -81.91 38.6 0.53 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.954 0.407 . . . . 10.0 111.657 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.528 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 1.6 t80 . . . . . 0 C--O 1.244 0.806 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.606 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.578 -0.209 . . . . 10.0 112.578 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -59.22 4.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.743 0.646 . . . . 10.0 112.743 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.8 tp -62.04 -31.77 72.21 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.891 0.377 . . . . 10.0 110.836 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.606 HE21 ' N ' ' A' ' 6' ' ' GLY . 7.3 tt0 -56.34 -33.85 66.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.786 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -97.27 -40.36 8.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.891 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.57 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.6 mt -60.61 -39.33 87.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.953 -0.567 . . . . 10.0 112.441 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.43 -36.58 81.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 10.0 111.155 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 tp -69.89 -37.3 75.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.178 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.46 -22.03 61.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.352 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.54 -51.49 7.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.087 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.0 tp -141.61 112.92 7.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.524 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.557 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 26.7 mt -80.63 93.53 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.22 -1.03 . . . . 10.0 108.22 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.416 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 85.5 tttt -106.19 94.15 9.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.678 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.557 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 3.0 Cg_endo -87.19 88.98 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.995 2.463 . . . . 10.0 110.683 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -138.43 -176.79 4.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.992 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -89.11 158.94 17.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.192 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.3 mm -100.68 162.45 3.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.406 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.9 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 1.5 tmtm? -177.75 128.14 0.3 Allowed Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.9 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 64.9 Cg_exo -39.44 138.07 0.84 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.739 2.959 . . . . 10.0 113.421 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.705 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.2 Cg_endo -57.74 138.14 84.61 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.965 2.444 . . . . 10.0 112.211 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 14.0 mt -71.53 121.74 85.22 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 24.0 Cg_endo -62.38 -23.63 75.23 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.886 2.391 . . . . 10.0 112.248 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -35.38 77.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.247 0.546 . . . . 10.0 109.975 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -116.07 -132.78 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.355 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -160.75 52.69 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.327 0.584 . . . . 10.0 109.989 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.6 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 15.0 tttm -154.6 149.32 26.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.843 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.705 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.7 pp -73.77 156.08 38.21 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.506 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -171.52 1.99 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.502 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -130.38 129.11 42.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.815 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -169.28 -63.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.073 0.463 . . . . 10.0 110.609 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.79 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-N 114.757 -1.11 . . . . 10.0 109.006 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tmm? . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.568 0.223 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.98 137.03 33.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.309 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.463 HG11 HD13 ' B' ' 57' ' ' LEU . 88.5 t -125.3 124.93 68.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.124 0.488 . . . . 10.0 111.263 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.739 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 61.8 m-85 -111.54 112.84 24.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.142 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.801 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -131.43 163.01 28.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.798 0.333 . . . . 10.0 111.191 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.7 mtm -128.54 108.27 10.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.2 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.43 HD13 ' HB ' ' B' ' 75' ' ' VAL . 49.7 mm -81.62 98.99 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.44 -0.948 . . . . 10.0 108.44 178.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.547 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.0 ttt180 -98.58 103.54 15.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 113.016 0.747 . . . . 10.0 113.016 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.5 ' HB2' HD23 ' B' ' 77' ' ' LEU . 27.5 ttp85 -89.27 72.09 8.16 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.102 -1.444 . . . . 10.0 107.102 177.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 67.87 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.058 -0.974 . . . . 10.0 110.139 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -107.94 -12.6 15.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.799 0.333 . . . . 10.0 111.108 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.481 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -95.65 91.75 6.27 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.094 -0.336 . . . . 10.0 110.094 179.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 5.2 m -94.57 120.24 34.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.005 0.431 . . . . 10.0 110.815 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.62 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 60.8 mt -109.99 119.38 58.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.685 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -74.34 117.22 15.9 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.801 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.9 OUTLIER -108.33 112.3 24.67 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.201 0.524 . . . . 10.0 111.813 -178.832 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.9 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.9 t70 -104.44 101.66 11.34 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.67 -167.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.871 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.409 ' O ' HD12 ' B' ' 57' ' ' LEU . 10.4 mmtt -123.48 161.7 24.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.47 -26.03 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.871 0.367 . . . . 10.0 111.63 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.82 -15.28 60.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.89 -0.596 . . . . 10.0 111.625 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 9.2 m -74.85 143.76 43.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.258 . . . . 10.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 19.2 p -94.94 165.9 12.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.822 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.433 HG13 HD12 ' B' ' 44' ' ' LEU . 53.9 t -63.99 -37.42 79.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.815 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -62.93 -35.1 78.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.451 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.439 ' O ' HG13 ' B' ' 30' ' ' ILE . 30.3 mt-10 -63.94 -36.11 82.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.419 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.944 HD11 HD21 ' B' ' 57' ' ' LEU . 63.6 mt -62.01 -44.6 96.37 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.04 -40.31 93.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.963 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -64.86 -37.15 86.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.272 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.439 HG13 ' O ' ' B' ' 26' ' ' GLU . 96.3 mt -64.13 -47.02 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.9 t -64.46 -33.74 64.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.248 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.756 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 6.8 tt0 -57.86 -40.02 79.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.629 179.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.53 -2.52 90.54 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.654 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.1 mt -106.8 -51.6 7.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.944 0.402 . . . . 10.0 111.281 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.58 -7.67 49.54 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.238 0.459 . . . . 10.0 112.238 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 62.39 29.48 17.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.932 0.396 . . . . 10.0 111.422 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.422 ' HA ' ' HD3' ' B' ' 37' ' ' ARG . 9.7 mmt180 -114.99 136.63 22.61 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.19 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.94 128.8 31.76 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.282 2.654 . . . . 10.0 112.684 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.756 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 51.5 Cg_endo -69.57 -14.46 36.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.384 2.723 . . . . 10.0 111.812 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.78 -43.72 85.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -99.12 14.54 28.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.921 -0.581 . . . . 10.0 112.096 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -87.07 127.2 35.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.211 -0.45 . . . . 10.0 109.929 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 31.8 mmt-85 -115.34 115.2 26.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.433 HD12 HG13 ' B' ' 24' ' ' VAL . 84.6 mt -97.29 115.09 27.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.224 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.16 111.6 22.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.06 0.457 . . . . 10.0 111.819 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -111.21 128.35 55.89 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.977 -1.12 . . . . 10.0 107.977 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 60.99 32.06 19.92 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.29 0.567 . . . . 10.0 109.776 -179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 68.34 17.45 9.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.148 -0.933 . . . . 10.0 111.791 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -125.31 149.99 47.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.071 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 28.8 tp -79.22 136.97 37.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.627 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 86.5 mt -86.26 174.86 8.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 10.0 111.736 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -110.57 125.48 53.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -62.26 -27.64 69.15 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -178.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.63 2.11 79.79 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.686 -0.768 . . . . 10.0 113.973 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -105.14 148.7 26.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.081 0.44 . . . . 10.0 111.282 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.7 p -83.85 166.85 17.58 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.882 179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.944 HD21 HD11 ' B' ' 27' ' ' LEU . 44.3 mt -57.94 -41.53 82.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.406 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.82 93.74 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.795 -0.717 . . . . 10.0 111.81 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.87 -24.59 65.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.768 0.318 . . . . 10.0 111.157 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 84.8 m -84.53 5.04 29.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.927 0.394 . . . . 10.0 111.854 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.76 14.67 60.82 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.679 -0.772 . . . . 10.0 114.149 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -87.17 79.43 8.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 117.134 0.467 . . . . 10.0 110.748 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 73.3 p -97.64 167.67 10.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.51 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 10.0 111.281 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -77.08 -35.37 56.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.739 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -90.05 -32.73 16.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.042 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.739 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -110.09 98.87 8.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.272 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -114.73 155.26 46.45 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.297 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.493 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 29.0 Cg_endo -64.48 -16.49 55.41 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.229 1.952 . . . . 10.0 111.342 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -106.2 -1.03 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.466 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.978 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -158.04 88.44 2.39 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.879 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.533 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.6 Cg_exo -78.3 140.18 17.2 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.821 2.348 . . . . 10.0 111.18 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.25 114.55 6.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 10.0 111.459 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.75 114.05 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.497 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.43 ' HB ' HD13 ' B' ' 7' ' ' ILE . 51.4 t -116.42 133.54 62.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.05 135.42 13.69 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.2 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.8 tp -114.38 107.06 15.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.792 0.33 . . . . 10.0 111.351 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.636 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -100.69 145.17 28.77 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -125.13 114.75 19.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -77.88 99.78 6.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.13 0.49 . . . . 10.0 111.44 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.408 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -117.74 128.54 54.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.21 131.91 51.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.822 0.304 . . . . 10.0 111.822 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 9.5 t70 73.27 -0.3 3.42 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.62 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 10.9 m -104.28 100.28 10.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.12 0.486 . . . . 10.0 110.518 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -67.78 -10.23 50.89 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.704 0.631 . . . . 10.0 112.704 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.426 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.7 tt0 -60.17 -22.84 63.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.942 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.02 -29.85 68.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.043 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 65.3 mt -83.73 -32.42 25.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.76 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.1 m -66.19 -37.08 84.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.741 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 2.4 mt -92.3 11.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.889 0.376 . . . . 10.0 111.585 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.5 101.49 17.63 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.821 0.343 . . . . 10.0 110.652 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 32.6 Cg_exo -63.84 -10.17 21.6 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.411 2.74 . . . . 10.0 112.8 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.01 -28.8 35.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.048 0.452 . . . . 10.0 110.999 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 11.8 m -113.84 -21.16 10.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.925 0.393 . . . . 10.0 111.596 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.463 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.8 m -126.57 149.25 67.47 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.376 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.89 162.42 41.98 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.634 2.223 . . . . 10.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.19 150.09 71.26 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.43 2.086 . . . . 10.0 111.652 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.55 84.41 3.93 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.291 0.567 . . . . 10.0 110.915 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.5 tp -108.49 122.46 40.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.115 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.8 Cg_exo -66.24 130.31 23.73 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.754 2.302 . . . . 10.0 111.06 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -35.71 81.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.025 0.441 . . . . 10.0 111.145 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.516 HG23 ' HG2' ' B' ' 103' ' ' MET . 30.6 m -73.07 -18.48 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.753 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.516 ' HG2' HG23 ' B' ' 102' ' ' VAL . 90.0 mmm -111.53 28.55 8.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.754 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.52 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 88.0 tttt -94.76 -51.04 0.25 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 112.807 0.669 . . . . 10.0 112.807 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 10.7 Cg_exo -72.9 56.54 3.01 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 122.593 2.195 . . . . 10.0 112.403 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' B' ' 115' ' ' GLN . 2.8 mt-30 -132.29 127.91 36.64 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -73.98 146.77 43.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.859 0.361 . . . . 10.0 111.913 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.7 m -63.82 139.05 58.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.745 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.21 -117.62 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.867 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.66 -37.94 6.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.997 0.427 . . . . 10.0 111.089 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.978 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 13.8 m -95.13 169.78 9.87 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.782 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.46 142.1 39.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 70.92 -5.49 1.48 Allowed 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.573 0.546 . . . . 10.0 111.361 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -84.64 112.08 20.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.263 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.462 ' HB3' ' HB2' ' B' ' 106' ' ' GLN . 43.8 mt-30 -106.72 143.66 34.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.255 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.18 114.29 26.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.6 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -71.91 132.25 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.057 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.086 0.469 . . . . 10.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.683 0.278 . . . . 10.0 111.083 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.566 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.0 ttpt -113.2 113.43 25.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.45 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.427 HD22 ' HE2' ' C' ' 44' ' ' PHE . 40.0 mt -90.46 121.46 32.45 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 42.1 mt -106.04 130.0 58.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.088 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -101.3 170.63 8.11 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.625 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -59.15 -24.6 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -81.65 -2.65 51.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.319 . . . . 10.0 111.454 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.66 12.64 74.59 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.812 -0.709 . . . . 10.0 111.561 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.48 124.45 28.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.494 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 16.6 mt-10 -99.86 121.83 41.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.018 -179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -113.51 112.55 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.777 0.323 . . . . 10.0 111.504 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.62 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 13.8 mm -89.54 119.25 36.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.2 t -104.55 134.99 44.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.9 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 69.2 tttt -62.69 128.94 38.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' C' ' 15' ' ' ARG . 29.8 ttt180 -52.27 -38.04 57.13 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.379 0.424 . . . . 10.0 112.098 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.412 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.0 tt0 -54.59 -44.17 72.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.924 0.392 . . . . 10.0 111.206 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -80.22 -35.06 36.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.169 0.509 . . . . 10.0 110.215 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.36 87.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.51 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 74.6 mt -58.71 -50.67 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.585 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.26 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.486 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.2 m -64.99 -34.65 78.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.167 0.508 . . . . 10.0 109.858 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.87 -2.05 90.0 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.824 -0.625 . . . . 10.0 112.291 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -88.59 -23.4 23.12 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 17.3 mt -80.76 152.78 4.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -72.26 80.86 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 10.0 110.769 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.33 165.98 14.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.42 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 85.5 mmm -78.85 40.4 0.39 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.26 -24.76 64.02 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.344 -0.614 . . . . 10.0 109.344 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.33 14.36 13.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.01 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.22 -61.73 6.99 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 115.835 -0.621 . . . . 10.0 113.138 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -71.49 -165.87 0.22 Allowed 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.679 2.253 . . . . 10.0 112.243 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.0 -51.57 10.17 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.589 -0.815 . . . . 10.0 112.219 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -144.15 142.53 30.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.82 0.343 . . . . 10.0 110.233 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -114.22 88.45 2.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.757 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.84 161.53 30.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.077 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.35 -31.0 69.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.331 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -64.11 -38.5 91.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.152 0.501 . . . . 10.0 110.254 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.429 ' O ' HG22 ' C' ' 42' ' ' VAL . 22.0 tp10 -73.4 -24.69 60.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.637 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -78.34 -11.63 59.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.051 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -86.46 -55.34 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.674 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.566 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 53.9 mt-10 -129.75 91.65 3.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.359 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.429 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.7 t -78.24 124.38 36.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.309 -0.405 . . . . 10.0 109.961 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -98.79 106.26 18.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 10.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.474 ' HB3' HD12 ' C' ' 47' ' ' ILE . 81.1 m-85 -88.05 91.35 8.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.159 0.504 . . . . 10.0 110.939 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 45' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 47.8 mtt180 -76.09 134.91 39.9 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.29 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 4.7 mm-40 77.47 4.6 3.1 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 124.018 0.824 . . . . 10.0 112.174 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.8 mt -109.18 115.97 55.9 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.549 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 23.8 Cg_exo -67.31 151.25 80.99 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 123.104 2.536 . . . . 10.0 111.926 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.1 p -63.0 -37.87 88.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.64 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -55.66 -55.27 34.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.901 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.6 -31.6 53.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.627 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 25.8 tp -65.54 -40.01 92.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.934 0.397 . . . . 10.0 110.102 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -62.32 -34.93 77.58 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.113 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -64.95 -39.81 94.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.894 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.73 -49.22 76.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.361 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 63.3 m -57.01 -41.39 78.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.158 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -64.51 -41.11 96.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.128 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.57 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 78.1 t80 -65.48 -41.83 92.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.652 179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.462 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.9 m-85 -63.57 -45.04 92.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 46.4 m -59.33 -43.97 92.67 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.451 0.643 . . . . 10.0 109.68 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.493 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 36.9 t80 -63.76 -44.59 93.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.135 179.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -61.39 -40.39 94.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.938 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.462 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.6 t -57.16 -52.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.858 0.361 . . . . 10.0 110.589 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -70.81 -38.24 73.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.248 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.71 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 76.8 t80 -56.73 -50.24 72.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.045 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.84 -13.33 59.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.87 0.367 . . . . 10.0 111.84 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 67' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 37.3 t30 -88.64 -44.82 10.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -154.39 -31.0 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.873 0.694 . . . . 10.0 112.873 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.71 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.7 m -74.8 29.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 -179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.1 -1.22 39.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.216 0.531 . . . . 10.0 110.399 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -76.5 -24.52 53.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.396 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.488 HG12 ' O ' ' C' ' 69' ' ' SER . 31.7 pt -96.13 166.17 14.87 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.428 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.86 175.74 8.58 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.928 2.419 . . . . 10.0 112.661 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -72.59 171.72 11.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.476 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -50.77 128.6 27.18 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.675 0.274 . . . . 10.0 111.043 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -53.89 128.01 27.91 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.185 2.59 . . . . 10.0 112.979 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.58 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.1 pt -85.48 41.72 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.149 0.499 . . . . 10.0 111.113 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -90.96 -55.89 0.26 Allowed Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.96 -0.563 . . . . 10.0 112.456 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 8.4 Cg_exo -72.14 128.58 14.05 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.888 1.725 . . . . 10.0 111.011 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -75.2 0.46 16.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.0 mm -85.85 99.35 7.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.272 0.558 . . . . 10.0 111.35 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -168.02 -42.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.049 -0.978 . . . . 10.0 109.457 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.416 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 29.1 tp -65.84 -26.86 67.85 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.622 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 29.6 mp0 -62.91 -31.84 72.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.9 -1.045 . . . . 10.0 109.884 178.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.705 ' HB3' HD21 ' A' ' 8' ' ' LEU . 66.4 mt -79.72 -35.12 39.41 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -23.99 67.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.403 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 49.5 ttp -58.99 -28.95 66.85 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.269 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 88' ' ' ALA . . . . . 0.51 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -58.03 -43.07 86.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.608 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.16 -52.42 0.59 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.164 1.172 . . . . 10.0 114.164 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -79.61 25.15 0.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.294 0.479 . . . . 10.0 112.294 -178.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.51 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 58.7 m-85 . . . . . 0 C--O 1.244 0.791 0 CA-C-O 118.699 -0.667 . . . . 10.0 109.625 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.539 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.453 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.44 -62.89 1.53 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.265 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' C' ' 85' ' ' LEU . 37.3 tp -61.01 -34.01 74.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.982 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.427 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 60.3 tt0 -58.53 -30.23 66.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.133 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -98.63 -38.32 9.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.02 0.438 . . . . 10.0 110.473 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.507 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 77.5 mt -63.4 -35.7 81.29 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.94 -0.573 . . . . 10.0 112.233 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.38 92.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 10.0 110.329 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.99 -22.83 62.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.125 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.17 -9.54 59.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.309 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.467 ' HB2' ' CE1' ' C' ' 58' ' ' TYR . . . -105.14 -51.16 3.08 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.407 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' C' ' 77' ' ' ILE . 0.2 OUTLIER -137.2 129.11 29.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.736 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.407 ' H ' HD12 ' A' ' 17' ' ' ILE . 2.5 mp -91.28 97.65 7.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 52.4 tttt -111.53 103.68 55.32 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.951 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -97.05 45.17 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.429 2.753 . . . . 10.0 111.611 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.555 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 28.9 mttt -93.28 -178.08 4.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.413 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -82.33 147.86 28.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.21 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.444 HD11 ' HG ' ' C' ' 83' ' ' LEU . 30.7 mm -110.33 106.45 20.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.15 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.006 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -121.87 135.49 25.32 Favored Pre-proline 0 C--N 1.32 -0.695 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.538 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.4 Cg_exo -34.25 135.12 0.13 Allowed 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 124.176 3.251 . . . . 10.0 113.6 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.723 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 13.4 Cg_endo -56.64 141.09 91.49 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 123.293 2.662 . . . . 10.0 112.511 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.434 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -78.81 118.42 72.31 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.763 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 19.9 Cg_endo -59.98 -21.27 64.22 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.391 2.727 . . . . 10.0 113.165 -179.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -63.97 -34.55 78.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.818 0.342 . . . . 10.0 111.095 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.668 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.3 t -122.68 -112.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -175.21 61.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.185 0.517 . . . . 10.0 111.095 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.3 tttm -159.85 151.87 20.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.447 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.723 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -70.76 156.64 39.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.818 0.342 . . . . 10.0 110.744 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -103.01 170.81 7.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.107 -179.27 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -119.88 111.89 18.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.844 0.354 . . . . 10.0 110.741 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.006 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -151.57 -72.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.183 -179.902 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.41 -62.63 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.309 -0.853 . . . . 10.0 109.511 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.877 0.37 . . . . 10.0 111.022 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -166.69 121.72 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.671 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.27 117.14 48.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.996 0.427 . . . . 10.0 110.856 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.42 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 68.8 m-85 -104.25 115.47 30.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.653 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.746 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -130.71 156.33 45.12 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.892 0.377 . . . . 10.0 111.37 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.555 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 55.2 mtm -125.61 111.81 15.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.874 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.548 HD13 ' HB ' ' B' ' 75' ' ' VAL . 42.8 mm -82.19 104.32 10.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -100.27 97.39 8.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.547 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.0 ttp85 -89.19 75.71 7.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.7 -1.222 . . . . 10.0 107.7 177.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 22.3 t-80 67.13 -87.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.448 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.46 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 65.4 mttt -113.67 11.09 18.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 10.0 111.001 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 5.8 m -116.61 96.92 5.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.383 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 24.6 m -96.13 121.14 37.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.897 0.38 . . . . 10.0 110.933 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.567 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.1 mt -112.21 119.19 59.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.358 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.16 122.84 26.18 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.746 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -116.6 118.39 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.036 0.446 . . . . 10.0 112.003 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -103.4 101.58 11.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.96 -169.4 2.03 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.275 0.36 . . . . 10.0 110.784 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -127.54 163.82 23.33 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.6 -25.83 64.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -18.94 60.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.839 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.406 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 10.8 m -71.68 141.26 49.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.615 -0.266 . . . . 10.0 110.729 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.3 p -91.78 163.96 13.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.625 -0.261 . . . . 10.0 110.63 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.432 HG21 ' HB3' ' B' ' 51' ' ' LEU . 65.2 t -63.78 -36.32 76.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.925 0.393 . . . . 10.0 110.577 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -61.29 -36.13 79.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.645 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -63.33 -34.26 77.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.171 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.67 HD11 HD21 ' B' ' 57' ' ' LEU . 75.1 mt -61.58 -42.58 99.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.0 -32.03 73.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.283 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' B' ' 29' ' ' ARG . 19.0 mtp180 -66.08 -39.5 90.09 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 70.1 mt -67.33 -43.46 87.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.6 t -61.57 -38.09 79.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.432 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 38.4 tt0 -62.41 -30.12 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.537 . . . . 10.0 110.271 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.73 -0.14 86.2 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.869 -0.682 . . . . 10.0 112.362 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.9 mt -115.64 -55.29 4.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 10.0 111.079 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 66.4 mt -88.42 -11.5 45.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.453 -0.339 . . . . 10.0 111.138 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 46.4 mttt 55.7 52.84 10.31 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.918 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.63 146.57 62.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.689 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -54.49 121.76 10.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.963 2.442 . . . . 10.0 112.268 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.74 -16.65 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.783 2.322 . . . . 10.0 111.928 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -26.75 65.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.387 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -101.22 9.62 41.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.229 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -95.03 131.12 41.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.453 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 56.8 mmt-85 -117.9 114.26 22.96 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 82.1 mt -94.15 117.77 30.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.779 0.324 . . . . 10.0 110.56 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -111.44 124.5 52.39 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 112.268 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 38.9 tttm -127.22 128.34 45.9 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 61.59 31.66 18.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.899 0.381 . . . . 10.0 110.642 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 70.91 13.44 7.04 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.378 -0.828 . . . . 10.0 111.89 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -124.25 144.89 49.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.804 0.335 . . . . 10.0 111.039 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 42.4 tp -73.26 127.69 33.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.502 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.432 ' HB3' HG21 ' B' ' 24' ' ' VAL . 97.1 mt -70.46 155.76 40.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.027 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 20.3 t0 -87.27 118.21 26.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.647 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.81 -28.1 68.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.825 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.91 24.39 32.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.454 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 23.8 mttp -127.78 160.16 32.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.963 0.411 . . . . 10.0 111.02 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 35.0 p -89.12 166.59 13.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.215 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.67 HD21 HD11 ' B' ' 27' ' ' LEU . 44.0 mt -59.35 -40.53 86.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.01 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.07 -39.9 96.38 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.875 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -72.83 -17.39 61.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.962 0.41 . . . . 10.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 60.2 m -94.91 5.96 50.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.728 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.52 16.89 63.17 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.71 -0.757 . . . . 10.0 113.355 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 36.9 m-85 -84.64 63.62 8.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.151 0.5 . . . . 10.0 110.451 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 3.5 p -84.85 149.83 25.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.12 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 2.3 m -62.49 -21.58 65.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.992 0.425 . . . . 10.0 110.673 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -63.76 -30.26 71.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.208 -0.451 . . . . 10.0 109.904 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.16 5.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.751 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.42 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -90.58 87.84 6.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.164 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -100.11 159.55 29.51 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.112 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.86 -16.76 55.84 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.638 2.225 . . . . 10.0 111.897 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.412 HE21 ' HB2' ' B' ' 70' ' ' GLN . 0.0 OUTLIER -113.67 5.95 16.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.442 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.606 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -156.26 79.05 4.08 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.339 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.555 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.6 Cg_exo -74.29 141.78 29.37 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.612 2.208 . . . . 10.0 111.545 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.09 123.53 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.069 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 123.6 24.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.571 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.548 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.0 t -123.77 129.19 74.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.55 133.43 11.8 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.697 -0.763 . . . . 10.0 111.896 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.4 tp -110.29 99.1 8.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.009 0.433 . . . . 10.0 111.116 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.453 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -95.65 114.3 26.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.013 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -97.84 118.77 35.15 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -83.46 100.86 11.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.146 0.498 . . . . 10.0 111.244 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -120.36 141.11 50.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.695 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.61 137.51 54.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 4.7 t70 70.79 11.81 7.16 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.409 0.623 . . . . 10.0 110.854 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 9.4 m -111.68 98.85 7.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.214 0.531 . . . . 10.0 111.063 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -72.78 -17.92 61.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.576 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 30.0 tt0 -56.98 -26.05 59.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.641 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.67 -16.8 61.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.71 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 58.7 mt -93.4 -15.57 25.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.949 0.404 . . . . 10.0 111.345 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 24.0 m -91.93 -30.26 16.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.115 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.2 mt -85.45 -3.3 8.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.29 0.567 . . . . 10.0 110.597 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -100.38 110.29 59.59 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.152 -0.477 . . . . 10.0 111.079 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 59.7 Cg_endo -72.72 -1.67 10.71 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.027 2.485 . . . . 10.0 111.736 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -84.57 -24.37 29.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.195 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -112.79 -39.4 4.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.599 -0.728 . . . . 10.0 111.064 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 25.5 m -117.34 155.62 49.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.978 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.16 154.98 42.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.558 2.172 . . . . 10.0 111.912 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.44 135.22 68.15 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.855 2.37 . . . . 10.0 112.014 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -76.69 106.08 8.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.316 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 27.4 tp -141.64 121.29 8.2 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.687 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 26.0 Cg_exo -64.81 133.15 35.13 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.535 2.157 . . . . 10.0 111.687 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -60.72 -27.67 68.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.53 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.668 ' HB ' HG13 ' A' ' 29' ' ' VAL . 18.1 m -65.02 -25.14 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.279 0.561 . . . . 10.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.493 ' HG2' HG23 ' B' ' 102' ' ' VAL . 83.4 mmm -121.47 54.88 1.1 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.281 -1.007 . . . . 10.0 108.281 179.308 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.648 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 69.7 tttt -126.87 -54.96 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.465 -0.789 . . . . 10.0 112.445 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 3.5 Cg_exo -82.23 70.11 7.18 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.633 2.222 . . . . 10.0 111.645 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -128.64 -167.41 1.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.796 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.784 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.6 t70 -93.41 179.78 5.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 8.6 m -110.7 136.57 49.58 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.66 0.267 . . . . 10.0 110.402 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -86.35 -147.71 11.07 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.511 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 3.6 m -111.66 -22.47 11.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.334 0.588 . . . . 10.0 110.348 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.625 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.0 OUTLIER -86.63 159.79 19.1 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.604 -0.725 . . . . 10.0 109.918 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 112' ' ' ALA . . . . . 0.606 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.4 121.95 15.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 t30 69.94 17.28 7.51 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.782 0.677 . . . . 10.0 111.572 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.625 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 65.4 tt0 -81.78 129.54 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.995 0.426 . . . . 10.0 110.249 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -110.13 143.04 40.79 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.097 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -114.09 105.76 13.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.353 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.418 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 1.9 t -72.38 137.65 23.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.911 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.447 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 22.5 mp0 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.494 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.89 0.376 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -104.16 108.36 19.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.174 -0.467 . . . . 10.0 111.181 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.704 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 47.8 mt -81.8 126.66 32.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.527 HD11 ' HB3' ' C' ' 41' ' ' GLU . 40.9 mt -108.13 114.14 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.813 0.34 . . . . 10.0 110.582 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.66 165.66 16.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.674 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m -61.65 -25.68 67.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.908 0.385 . . . . 10.0 111.655 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -79.02 0.15 28.86 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.647 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.71 26.22 59.15 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 9' ' ' HIS . . . . . 0.46 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 1.8 t60 -91.08 138.79 31.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.44 . . . . 10.0 110.381 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.58 132.53 49.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.316 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.704 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 59.9 m-85 -125.12 106.85 10.22 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.257 -0.428 . . . . 10.0 109.983 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.567 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 27.4 mm -88.68 110.81 21.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.148 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 43.1 t -98.51 125.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.04 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -59.74 128.25 35.99 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.298 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.46 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 33.0 ttt-85 -53.28 -31.26 42.94 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.33 -0.395 . . . . 10.0 111.639 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -52.34 -44.8 65.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.078 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -87.09 -30.03 21.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.514 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 18' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -62.42 -32.44 73.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.025 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.1 -46.87 87.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.739 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.439 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.6 m -72.61 -36.21 68.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.408 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 27.5 m -65.26 -24.07 67.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.146 0.498 . . . . 10.0 110.301 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.71 -8.33 82.96 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.694 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -87.74 -19.57 27.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.454 0.645 . . . . 10.0 109.584 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -79.21 148.35 6.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.313 -0.858 . . . . 10.0 109.312 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.7 79.8 0.84 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 10.0 110.697 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -90.01 172.87 8.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.313 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.539 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.8 mmm -82.87 38.59 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.11 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mp -66.8 -32.57 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.288 0.566 . . . . 10.0 109.811 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -90.17 14.54 12.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.957 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.56 -62.5 3.83 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.657 -0.701 . . . . 10.0 112.89 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.99 -167.5 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.726 2.284 . . . . 10.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.63 -90.01 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.962 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -116.08 132.33 56.69 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.706 -0.291 . . . . 10.0 110.534 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.76 92.95 8.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.306 -0.406 . . . . 10.0 109.987 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.73 176.51 8.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.187 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.37 -25.74 68.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.268 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.86 -48.07 78.18 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.458 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.2 mp0 -70.46 -24.45 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.246 -0.888 . . . . 10.0 111.324 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 5.1 m -78.29 -47.05 18.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.017 0.437 . . . . 10.0 110.621 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -70.83 -44.16 67.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.878 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.527 ' HB3' HD11 ' C' ' 4' ' ' ILE . 49.5 mt-10 -128.62 103.27 7.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.436 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.458 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -90.01 104.69 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 43' ' ' ASN . . . . . 0.431 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 14.6 t-20 -84.22 128.5 34.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.669 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.538 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 81.4 m-85 -109.15 124.43 50.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.345 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -96.41 128.1 43.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.334 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 67.48 19.76 9.93 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 10.0 112.79 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' C' ' 44' ' ' PHE . 67.2 mt -113.45 111.4 49.54 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.212 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.7 143.57 46.68 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 123.038 2.492 . . . . 10.0 111.645 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -34.9 70.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.904 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.11 -55.54 31.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 10.0 111.742 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.6 m -71.33 -30.42 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.99 -0.284 . . . . 10.0 111.002 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 43.9 tp -64.34 -35.9 82.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.447 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -59.59 -39.76 85.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.589 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -65.73 -36.18 82.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.315 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 36.3 t -68.53 -44.28 83.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.64 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.28 -42.3 98.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.614 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 72.1 mtm -66.4 -35.21 79.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.467 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.507 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 75.7 t80 -65.21 -42.65 93.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.174 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.47 ' O ' HG23 ' C' ' 63' ' ' VAL . 9.5 m-85 -62.39 -47.44 84.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.703 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.0 m -57.53 -42.46 82.92 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.944 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -64.48 -45.57 86.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.364 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptt -63.79 -34.83 78.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 112.006 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.47 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -62.01 -40.76 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.102 0.477 . . . . 10.0 110.52 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -84.52 -34.45 23.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.737 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.701 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 45.9 t80 -57.71 -57.33 13.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.027 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.97 54.47 3.1 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 67' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 0.8 OUTLIER -162.16 -58.87 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.322 -179.049 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.58 -33.82 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.634 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.701 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 7.2 m -87.12 35.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.082 0.468 . . . . 10.0 111.949 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -9.76 59.09 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.012 0.434 . . . . 10.0 110.535 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -92.95 -9.54 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.658 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 34.1 pt -100.17 164.36 16.53 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.155 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.61 164.23 27.2 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.625 2.217 . . . . 10.0 112.948 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.8 tp10 -72.63 170.63 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.315 178.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.477 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 29.9 t80 -48.15 128.24 12.3 Favored Pre-proline 0 C--O 1.233 0.197 0 O-C-N 123.295 0.372 . . . . 10.0 110.824 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.96 121.77 5.45 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.545 2.83 . . . . 10.0 113.395 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.576 ' HA ' ' HG ' ' A' ' 16' ' ' LEU . 2.7 pt -80.15 45.81 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.576 -0.738 . . . . 10.0 111.855 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.638 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.21 -57.5 0.1 Allowed Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 112.724 0.639 . . . . 10.0 112.724 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.638 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 2.6 Cg_exo -76.37 97.01 1.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.202 1.935 . . . . 10.0 111.59 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.77 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -74.28 59.81 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.684 0.624 . . . . 10.0 112.684 -179.525 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.1 mm -116.25 13.73 7.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.879 0.847 . . . . 10.0 108.942 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.56 -38.43 54.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.328 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 15.4 tp -66.58 -30.07 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.137 0.494 . . . . 10.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.542 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 17.5 mp0 -61.42 -35.77 78.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.397 -0.82 . . . . 10.0 109.827 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 8' ' ' LEU . 46.5 mt -80.73 -33.55 35.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.335 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 3.3 tt -63.13 -27.15 69.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.685 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.2 ttp -59.5 -20.73 57.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.767 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -42.06 88.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.606 0.241 . . . . 10.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.59 -50.94 0.51 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -79.98 12.15 2.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.883 0.373 . . . . 10.0 111.586 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.53 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 72.6 m-85 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.329 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.425 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.316 -0.314 . . . . 10.0 112.316 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -67.93 0.28 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.164 0.801 . . . . 10.0 113.164 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' C' ' 85' ' ' LEU . 41.8 tp -63.95 -32.31 73.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.585 -0.279 . . . . 10.0 111.514 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.408 ' HG3' ' HG ' ' C' ' 86' ' ' LEU . 63.0 tt0 -57.6 -42.77 83.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.041 0.448 . . . . 10.0 110.25 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -78.88 -40.28 32.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.994 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.447 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 83.4 mt -61.02 -32.77 72.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.62 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.86 -43.52 92.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.791 0.329 . . . . 10.0 110.544 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 tp -70.27 -22.73 62.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.44 0.638 . . . . 10.0 109.956 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.77 2.23 56.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.368 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -114.07 -39.41 3.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.157 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.7 OUTLIER -156.68 118.91 3.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.016 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.1 mt -86.48 85.57 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 13.9 ttpt -96.21 111.89 57.98 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.159 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -95.46 36.04 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.315 2.677 . . . . 10.0 111.352 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -82.29 -177.95 6.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.341 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.836 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 28.4 mm-40 -87.35 166.03 15.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.547 0.573 . . . . 10.0 112.547 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.0 mm -116.41 143.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.691 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.122 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 0.1 OUTLIER -168.83 143.03 2.52 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.035 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 1.122 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 65.8 Cg_exo -43.74 140.28 4.72 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.258 2.639 . . . . 10.0 112.526 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.817 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.2 Cg_endo -63.84 139.28 67.64 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.859 2.373 . . . . 10.0 111.826 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -76.44 125.72 87.19 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.66 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.59 -11.03 30.09 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.097 2.531 . . . . 10.0 112.936 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -42.38 76.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.135 0.493 . . . . 10.0 110.478 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -119.5 -125.51 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -159.41 55.56 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.38 0.61 . . . . 10.0 110.727 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 17.9 tttm -153.06 154.11 34.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.408 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.817 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -76.52 156.38 32.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.716 0.293 . . . . 10.0 110.935 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -95.53 169.91 9.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.601 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.836 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 25.1 tt0 -122.32 119.41 31.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.03 0.443 . . . . 10.0 110.967 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.086 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -153.17 -68.25 0.15 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.991 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.0 -56.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.806 -0.616 . . . . 10.0 109.875 179.908 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tmm? . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 121.02 0.438 . . . . 10.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -79.23 137.17 37.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.003 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.572 HG11 HD13 ' B' ' 57' ' ' LEU . 98.3 t -123.6 119.49 57.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.29 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.555 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.6 m-85 -109.3 115.03 29.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.994 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.792 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.8 OUTLIER -131.13 159.75 36.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.811 0.339 . . . . 10.0 111.39 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 35.0 mtm -127.52 106.17 8.99 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.862 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -78.36 105.39 7.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -107.62 104.15 13.62 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 -178.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.45 ' HB2' HD23 ' B' ' 77' ' ' LEU . 16.5 ttp85 -92.54 76.39 5.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.339 -1.356 . . . . 10.0 107.339 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.722 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.4 t-80 67.6 -81.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.428 -0.805 . . . . 10.0 111.083 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 mttt -113.87 -12.65 12.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.94 0.4 . . . . 10.0 111.743 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.5 105.14 17.37 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.6 m -106.68 120.48 42.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.63 0.253 . . . . 10.0 111.24 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.48 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 58.3 mt -113.44 118.09 57.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.81 -179.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -77.26 118.42 19.73 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.792 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -110.02 116.74 32.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.448 0.642 . . . . 10.0 112.003 -178.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.836 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -101.59 97.99 8.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.706 -1.22 . . . . 10.0 107.706 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.44 -169.69 1.9 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.222 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -127.43 158.49 37.2 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.73 -20.7 61.81 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.467 0.543 . . . . 10.0 112.467 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.19 -15.29 58.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.835 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 20.1 m -81.09 143.27 32.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.742 0.306 . . . . 10.0 111.367 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 40.0 p -90.55 168.28 11.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.455 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 57.2 t -64.63 -34.32 69.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.638 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -62.2 -35.94 80.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.412 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -63.5 -29.8 71.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.105 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.927 HD11 HD21 ' B' ' 57' ' ' LEU . 81.1 mt -67.21 -47.31 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -61.36 -33.34 73.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.877 -0.602 . . . . 10.0 110.573 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.55 -34.31 77.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.138 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.1 mt -70.57 -46.85 68.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.67 -36.41 73.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.327 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -57.58 -40.25 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.69 -14.66 79.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.85 -0.691 . . . . 10.0 113.241 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 88.0 mt -95.42 -51.94 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 122.663 -0.316 . . . . 10.0 111.399 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 46.1 mt -85.54 -11.63 53.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.452 0.538 . . . . 10.0 112.452 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.7 mttm 60.92 41.24 14.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' B' ' 37' ' ' ARG . 47.5 mtt-85 -131.82 151.55 78.76 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.85 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.42 131.51 46.67 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.308 2.672 . . . . 10.0 112.589 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.46 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 72.6 Cg_endo -77.95 -20.9 11.33 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.877 2.384 . . . . 10.0 111.971 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -70.68 -23.74 62.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -98.87 11.41 38.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.349 0.595 . . . . 10.0 111.194 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' GLN . . . . . 0.46 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 77.1 mt-30 -99.42 133.33 43.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.469 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.554 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 47.5 mmt-85 -115.0 118.22 32.8 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.492 ' HB3' HD12 ' B' ' 51' ' ' LEU . 41.1 mt -96.93 114.18 25.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.844 0.354 . . . . 10.0 111.144 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -112.33 127.23 55.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.137 0.494 . . . . 10.0 111.569 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -137.22 128.82 28.57 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.31 39.05 15.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.91 0.386 . . . . 10.0 111.214 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 64.27 17.06 10.51 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.353 -0.839 . . . . 10.0 111.808 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -128.72 155.19 45.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.858 0.361 . . . . 10.0 111.286 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.94 133.71 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.492 HD12 ' HB3' ' B' ' 44' ' ' LEU . 94.9 mt -76.77 155.95 32.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.835 0.35 . . . . 10.0 111.511 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -100.95 114.1 27.69 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.366 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.65 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 2.3 m-20 -64.86 -15.7 62.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.725 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.88 14.54 64.55 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.885 -0.674 . . . . 10.0 112.751 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -130.72 160.9 32.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.753 0.311 . . . . 10.0 110.693 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 43.4 p -86.6 165.56 16.09 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.927 HD21 HD11 ' B' ' 27' ' ' LEU . 84.7 mt -57.63 -39.68 77.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.398 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.06 85.33 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.998 -0.62 . . . . 10.0 112.382 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -81.15 -12.98 59.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.905 0.383 . . . . 10.0 111.507 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' CYS . . . . . 0.441 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 57.8 m -96.83 2.27 51.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 10.0 111.105 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.41 9.09 62.04 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.736 -0.745 . . . . 10.0 113.32 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.523 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 69.8 m-85 -86.28 62.6 7.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.233 0.539 . . . . 10.0 110.39 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.7 p -88.21 154.2 20.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.544 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.9 m -61.76 -15.36 40.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.053 0.454 . . . . 10.0 111.313 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -72.18 -38.21 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.263 0.554 . . . . 10.0 109.966 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.08 -46.11 7.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.554 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.555 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -87.76 92.85 9.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -99.4 154.11 37.45 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.17 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.96 -13.62 38.45 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.87 2.38 . . . . 10.0 112.078 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 11.0 pt20 -110.39 0.69 18.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.217 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.493 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -157.9 89.27 2.37 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.586 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.548 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.9 Cg_exo -74.03 141.78 30.22 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.742 2.295 . . . . 10.0 111.568 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.13 116.44 12.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.891 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.34 128.2 35.51 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.555 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 24.3 t -125.42 131.34 72.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.99 122.82 6.42 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.669 -0.777 . . . . 10.0 111.877 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' B' ' 9' ' ' ARG . 42.6 tp -101.53 106.16 17.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 10.0 111.128 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.554 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -101.07 105.51 16.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.458 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.04 117.65 30.04 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -81.7 106.19 13.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.008 0.432 . . . . 10.0 111.573 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.78 128.18 54.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.3 143.2 57.21 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.917 -0.313 . . . . 10.0 111.276 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.29 -3.39 1.85 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.515 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.46 96.17 5.29 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.539 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -77.72 12.65 1.59 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.955 -178.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -62.84 -26.83 68.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.65 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.08 78.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.972 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -70.0 -33.16 71.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.795 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.7 m -74.71 -30.78 61.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.774 -0.648 . . . . 10.0 111.21 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.722 HG12 ' HB2' ' B' ' 10' ' ' HIS . 59.0 mt -84.33 -35.29 10.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.252 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 28.6 tt0 -61.04 115.36 13.79 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.633 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.604 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.9 Cg_exo -65.93 -14.96 46.97 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.294 2.663 . . . . 10.0 112.51 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.59 -37.65 62.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.026 0.441 . . . . 10.0 110.147 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.37 -35.91 12.16 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.657 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.604 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 1.4 m -128.53 144.62 52.78 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.508 -0.314 . . . . 10.0 111.192 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.33 145.82 60.88 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.377 2.052 . . . . 10.0 111.083 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.66 128.61 28.92 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.896 2.397 . . . . 10.0 111.624 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -63.01 111.01 1.99 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.918 -0.583 . . . . 10.0 112.174 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 26.4 tp -131.08 131.56 23.25 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.048 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 31.3 Cg_exo -62.52 128.65 24.14 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 122.686 2.257 . . . . 10.0 111.733 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -65.41 -37.65 87.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.439 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' B' ' 103' ' ' MET . 28.1 m -67.22 -20.86 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.318 0.58 . . . . 10.0 110.694 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.506 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.3 mmm -114.65 52.98 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.027 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.714 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 33.1 tttm -126.27 -54.22 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 112.778 0.658 . . . . 10.0 112.778 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.714 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 72.8 Cg_endo -74.84 63.35 5.84 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.098 1.865 . . . . 10.0 111.858 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -128.92 -173.93 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.813 -0.631 . . . . 10.0 109.609 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.92 178.58 5.24 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.706 -0.397 . . . . 10.0 111.096 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -96.44 139.61 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.723 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 109' ' ' GLY . . . . . 0.424 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -89.13 -156.71 32.01 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.26 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.84 -34.23 16.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.092 0.472 . . . . 10.0 110.553 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.54 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.9 m -84.48 162.82 19.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.067 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 112' ' ' ALA . . . . . 0.493 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -70.18 129.08 38.41 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.17 4.45 4.9 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.757 0.661 . . . . 10.0 111.511 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.54 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 35.2 tt0 -75.4 141.06 43.3 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -118.19 147.19 43.61 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.091 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -120.32 109.86 15.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.225 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.482 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -77.23 137.41 22.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.122 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.859 179.273 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.235 0.304 0 CA-C-O 120.932 0.396 . . . . 10.0 110.732 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.497 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.9 ttpt -102.42 111.15 23.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.956 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 66.3 mt -92.2 111.37 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -97.37 122.43 48.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.975 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 10.3 p -95.34 171.47 8.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.804 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.8 m -70.19 -7.59 43.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.839 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -91.64 -3.63 56.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.01 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.39 5.66 84.78 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.16 -0.776 . . . . 10.0 111.16 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.11 121.2 26.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -102.52 120.47 40.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.274 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -106.9 123.57 48.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.211 -0.45 . . . . 10.0 111.547 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.4 mm -100.7 117.69 46.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.844 -0.798 . . . . 10.0 108.844 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.15 139.68 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.603 -0.147 . . . . 10.0 110.603 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.836 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 56.2 tttt -56.44 130.41 44.72 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.405 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 33.7 ttt180 -53.99 -37.99 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.759 0.281 . . . . 10.0 111.759 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.519 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 35.2 tt0 -55.84 -53.21 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 10.0 110.842 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -66.77 -36.57 82.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.717 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.14 86.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.827 179.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 69.5 mt -61.27 -52.02 66.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.701 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.401 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.8 m -60.81 -41.43 95.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -64.74 -39.28 93.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.715 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.76 -10.88 80.64 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.121 -0.561 . . . . 10.0 112.662 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -82.69 -15.26 52.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.508 0.671 . . . . 10.0 109.743 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.1 mt -88.34 159.63 2.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -67.33 86.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.105 0.479 . . . . 10.0 111.435 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.92 165.91 11.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.969 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.425 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 96.3 mmm -76.8 41.89 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.92 -28.68 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.263 0.554 . . . . 10.0 109.835 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.89 15.49 22.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.236 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.45 -64.54 3.92 Favored Glycine 0 CA--C 1.52 0.391 0 CA-C-N 115.758 -0.655 . . . . 10.0 113.039 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.72 -154.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.612 2.208 . . . . 10.0 111.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.57 -94.95 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.743 -0.741 . . . . 10.0 112.089 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -113.41 112.01 22.92 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.827 0.346 . . . . 10.0 110.728 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -81.6 100.71 9.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.528 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.07 156.56 39.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.619 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.78 -37.29 73.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.073 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -62.96 -36.53 83.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -71.7 -31.5 66.82 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.206 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -73.75 -32.93 64.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.979 0.419 . . . . 10.0 110.306 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -75.59 -37.73 59.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.497 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 36.5 mt-10 -132.55 88.31 2.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.731 179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.5 117.71 26.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.374 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -95.73 110.87 22.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.244 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.515 ' HB3' HD12 ' C' ' 47' ' ' ILE . 93.7 m-85 -94.66 115.58 27.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.895 0.379 . . . . 10.0 111.354 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -99.07 136.83 38.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.395 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 70.15 27.48 4.22 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.893 0.746 . . . . 10.0 111.703 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.515 HD12 ' HB3' ' C' ' 44' ' ' PHE . 78.4 mt -132.89 109.92 13.05 Favored Pre-proline 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.307 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.511 ' HG2' HG22 ' C' ' 51' ' ' VAL . 30.1 Cg_endo -64.89 152.22 83.01 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.912 2.408 . . . . 10.0 112.575 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.3 p -63.99 -34.44 78.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.946 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 50' ' ' HIS . . . . . 0.504 ' HE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -54.17 -57.7 10.15 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.511 HG22 ' HG2' ' C' ' 48' ' ' PRO . 35.8 m -64.77 -35.24 74.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.427 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.5 tp -63.98 -37.51 87.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.61 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 35.5 m -59.71 -40.67 88.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.584 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -68.49 -35.94 78.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.337 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.51 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -62.97 -47.98 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.27 -40.95 92.19 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.553 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.6 mtm -65.55 -41.31 93.13 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 56.0 t80 -65.43 -40.83 93.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.603 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.419 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.8 m-85 -62.66 -46.65 87.23 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 35.6 m -58.4 -44.62 89.05 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.329 0.585 . . . . 10.0 110.146 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.457 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 34.4 t80 -64.85 -41.84 95.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.36 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -63.26 -38.71 92.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.247 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.419 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.4 t -60.75 -47.54 92.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.8 mmt85 -71.65 -40.81 69.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.361 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.518 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 60.5 t80 -58.64 -47.58 83.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.981 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.59 32.39 0.79 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.968 0.413 . . . . 10.0 110.952 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -138.83 -56.01 0.61 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.649 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.04 -35.83 0.62 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.713 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.518 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.4 m -80.67 38.76 0.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.951 0.405 . . . . 10.0 111.892 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.01 -17.03 32.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.45 0.643 . . . . 10.0 109.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -78.46 -14.78 59.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.489 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.756 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.46 166.85 12.15 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.377 -0.601 . . . . 10.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.756 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 44.7 Cg_endo -67.79 166.61 23.77 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.201 1.934 . . . . 10.0 113.247 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.565 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 7.9 tp10 -74.37 171.75 13.13 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.417 -0.957 . . . . 10.0 108.417 178.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.565 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 18.2 t80 -52.3 128.49 40.8 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 110.394 -0.224 . . . . 10.0 110.394 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 76' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 44.5 Cg_exo -57.01 129.55 35.09 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.811 2.34 . . . . 10.0 112.249 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.537 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.1 pt -84.05 40.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.307 0.575 . . . . 10.0 111.437 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.69 -57.3 0.36 Allowed Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.736 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -70.17 117.0 4.86 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.789 1.66 . . . . 10.0 110.778 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.519 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 3.3 pt-20 -73.98 3.73 6.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 43.0 mm -83.07 82.11 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.398 0.618 . . . . 10.0 110.026 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.65 -37.36 0.12 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.428 -0.805 . . . . 10.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.513 ' HB3' ' HE2' ' A' ' 18' ' ' LYS . 20.1 tp -66.2 -25.42 66.92 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 22.4 mp0 -63.39 -32.93 74.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.715 -1.129 . . . . 10.0 109.508 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 8' ' ' LEU . 80.5 mt -78.42 -34.2 48.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.759 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 9' ' ' GLN . 6.2 tt -66.2 -27.86 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.067 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 46.8 ttp -59.21 -25.9 64.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.548 -0.751 . . . . 10.0 111.752 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.19 -29.23 70.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.993 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.96 -65.35 0.22 Allowed 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.472 0.916 . . . . 10.0 113.472 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -80.18 33.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.896 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.78 ' N ' HE21 ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 112.744 -0.142 . . . . 10.0 112.744 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -56.41 22.57 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 8' ' ' LEU . 2.0 tp -57.6 -34.84 69.68 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.78 HE21 ' N ' ' A' ' 6' ' ' GLY . 45.0 mt-30 -61.41 -37.19 82.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.045 0.45 . . . . 10.0 111.058 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -84.87 -41.95 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.52 -39.69 94.36 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.252 0.464 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.18 94.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.729 0.299 . . . . 10.0 111.011 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.83 -30.53 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.237 0.542 . . . . 10.0 110.475 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.07 -3.24 57.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.744 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.19 -41.0 5.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.426 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 0.2 OUTLIER -161.61 133.14 5.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.834 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.0 mt -99.69 100.41 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HB3' HD22 ' C' ' 83' ' ' LEU . 23.5 ttpt -108.89 101.66 45.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 10.0 111.283 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.55 71.36 4.68 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.308 2.672 . . . . 10.0 110.717 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 mttm -128.22 177.92 6.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.064 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -83.89 144.57 29.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.093 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.13 105.21 18.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.733 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.011 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -112.13 140.12 23.19 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 179.23 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.754 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 57.8 Cg_exo -40.36 132.53 2.31 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.47 2.78 . . . . 10.0 112.772 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.729 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.8 Cg_endo -59.11 141.36 98.03 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.282 2.655 . . . . 10.0 112.876 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.413 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -80.05 135.15 55.17 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.251 179.071 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.44 -7.5 21.39 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 122.862 2.375 . . . . 10.0 112.812 -178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -38.89 80.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.394 -0.367 . . . . 10.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 t -122.29 -117.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.23 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 7.5 ptp180 -166.75 49.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.992 0.425 . . . . 10.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.417 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.4 tttm -148.52 150.61 33.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.803 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.729 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.0 pp -74.47 156.03 37.38 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.769 0.319 . . . . 10.0 111.002 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -98.91 170.64 8.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.62 -179.079 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -119.16 125.72 49.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.011 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -166.76 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.84 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -174.73 -67.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.825 -0.435 . . . . 10.0 109.825 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.672 -0.68 . . . . 10.0 110.293 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.863 0.363 . . . . 10.0 110.579 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -81.68 143.08 32.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.039 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -133.22 112.26 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.868 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -97.92 110.15 22.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.167 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.628 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -122.18 153.71 38.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.937 0.399 . . . . 10.0 111.431 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 36.8 mtm -123.87 110.89 15.42 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.451 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.507 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -81.61 113.23 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.32 110.31 21.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.434 0.635 . . . . 10.0 112.635 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.421 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 28.5 ttp85 -103.36 68.63 0.97 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 107.034 -1.469 . . . . 10.0 107.034 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.559 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.8 t-80 66.16 -88.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.909 -1.041 . . . . 10.0 111.144 -178.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -96.8 -21.77 17.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.844 0.354 . . . . 10.0 111.455 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -90.1 120.3 31.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.495 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.49 125.13 48.16 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.989 -0.374 . . . . 10.0 109.989 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.598 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 63.8 mt -118.63 118.37 57.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.715 0.293 . . . . 10.0 111.6 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -80.73 115.34 20.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.628 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -112.08 112.32 23.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.076 0.465 . . . . 10.0 112.248 -178.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.62 100.75 13.43 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.639 -1.245 . . . . 10.0 107.639 177.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -120.65 -173.44 2.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.879 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 mmtt -125.88 160.57 29.55 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.03 -25.44 66.91 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.055 0.455 . . . . 10.0 111.203 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -2.18 49.63 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.9 m -86.74 141.28 29.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.685 0.279 . . . . 10.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.0 p -87.91 159.58 18.3 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.544 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 t -63.31 -35.22 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.919 0.39 . . . . 10.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.91 -35.94 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.58 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.401 ' O ' HG13 ' B' ' 30' ' ' ILE . 38.6 mt-10 -63.95 -34.62 78.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.048 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.92 HD11 HD21 ' B' ' 57' ' ' LEU . 78.4 mt -63.73 -44.98 91.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.27 -34.26 77.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.125 179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -65.64 -39.44 91.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.146 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 26' ' ' GLU . 73.7 mt -66.2 -42.73 91.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -63.14 -37.91 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.445 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.64 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.0 OUTLIER -63.67 -33.67 76.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.499 179.581 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.84 -26.57 66.69 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.495 -0.86 . . . . 10.0 112.458 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.4 mt -91.37 -57.49 4.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 70.0 mt -83.45 -15.48 49.44 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.384 0.512 . . . . 10.0 112.384 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 83.8 mttt 64.16 31.72 13.07 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.147 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.452 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 7.6 mmt180 -112.91 132.18 22.44 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.142 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 125.85 10.54 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.695 2.93 . . . . 10.0 113.436 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.64 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 43.1 Cg_endo -68.23 -20.39 43.25 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.938 2.425 . . . . 10.0 112.102 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.33 -31.76 73.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.287 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -98.97 10.86 40.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.036 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -93.67 128.37 39.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.859 0.362 . . . . 10.0 110.825 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.403 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 70.0 mmt-85 -118.72 111.2 18.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.031 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -93.28 121.14 34.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -114.78 122.12 45.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.13 0.49 . . . . 10.0 111.74 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.451 ' HG3' ' CZ ' ' B' ' 62' ' ' PHE . 4.5 tmtm? -118.19 123.52 45.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.401 -0.818 . . . . 10.0 108.833 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 57.4 43.19 23.57 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.443 0.465 . . . . 10.0 111.099 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 69.33 5.92 5.4 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -119.19 147.03 44.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.736 0.303 . . . . 10.0 111.549 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.23 132.47 43.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.521 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.8 mt -78.41 171.07 15.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -83.22 -157.53 0.24 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.603 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.62 -50.65 0.46 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.097 0.475 . . . . 10.0 110.012 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.18 -21.53 54.69 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.842 -0.694 . . . . 10.0 112.845 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -73.97 157.41 36.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.949 0.404 . . . . 10.0 111.013 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.6 p -90.64 169.25 11.16 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.465 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.92 HD21 HD11 ' B' ' 27' ' ' LEU . 79.2 mt -62.07 -35.59 79.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.598 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.04 -22.95 65.44 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.387 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -94.75 -6.53 42.84 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.756 0.313 . . . . 10.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 44.5 m -107.84 23.05 15.06 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.046 0.387 . . . . 10.0 112.046 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.94 28.09 71.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.961 -0.638 . . . . 10.0 113.519 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.451 ' CZ ' ' HG3' ' B' ' 46' ' ' LYS . 45.0 m-85 -107.26 99.41 8.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.904 0.383 . . . . 10.0 110.757 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -124.31 178.05 5.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 6.1 m -75.59 4.97 6.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.502 . . . . 10.0 111.154 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -97.31 -38.15 9.77 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.46 -39.79 18.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.197 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.77 107.52 17.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.776 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.507 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 66.8 mtt180 -118.91 161.74 34.77 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.103 -178.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.507 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 10.7 Cg_endo -53.69 -34.73 75.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.163 2.576 . . . . 10.0 113.264 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.579 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.33 11.37 27.21 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.233 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -151.01 77.09 7.75 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.674 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.1 Cg_exo -76.24 132.2 13.6 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.748 2.299 . . . . 10.0 111.617 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.18 122.79 18.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.546 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -78.46 126.15 30.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.478 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.507 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.3 t -121.77 130.33 74.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.14 135.28 13.52 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.653 -0.784 . . . . 10.0 111.84 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.3 tp -116.36 104.12 11.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.915 0.388 . . . . 10.0 111.333 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.403 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -97.95 119.55 36.77 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 66.3 t80 -98.96 123.16 43.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.286 -0.264 . . . . 10.0 110.286 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -75.03 78.09 2.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.279 0.561 . . . . 10.0 110.754 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.502 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -85.96 136.03 33.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -67.88 128.47 36.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.988 -0.551 . . . . 10.0 112.2 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.27 19.27 9.97 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.677 -0.692 . . . . 10.0 112.398 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.1 m -111.86 112.81 24.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.829 0.347 . . . . 10.0 110.529 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -77.44 -8.51 57.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.752 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.448 ' O ' HG13 ' B' ' 90' ' ' ILE . 54.7 tt0 -60.95 -28.63 69.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.367 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.19 -40.96 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.211 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.94 -21.31 60.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.371 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 30.5 m -83.83 -23.83 31.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.407 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' B' ' 10' ' ' HIS . 29.2 mt -90.53 -33.79 6.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.427 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.19 113.53 11.7 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.686 ' HA ' ' O ' ' B' ' 95' ' ' SER . 57.2 Cg_endo -71.66 -2.67 11.73 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.899 2.4 . . . . 10.0 112.182 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -80.53 -45.72 16.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.353 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -88.64 -28.96 20.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.811 -0.632 . . . . 10.0 111.542 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.686 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.3 m -132.29 136.55 28.26 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.647 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.1 151.24 79.94 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 122.553 2.169 . . . . 10.0 111.539 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.35 127.03 24.2 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.985 2.457 . . . . 10.0 112.12 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.58 120.85 14.13 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.773 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.418 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.5 tp -135.69 132.48 19.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.341 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.546 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 52.8 Cg_exo -58.22 127.7 25.87 Favored 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.635 2.223 . . . . 10.0 111.844 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.85 -36.47 83.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.958 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.424 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.3 m -73.15 -21.76 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.132 0.491 . . . . 10.0 111.104 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.546 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.7 mmm -111.42 62.18 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.65 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 83.7 tttt -131.27 -55.08 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.851 0.685 . . . . 10.0 112.851 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -74.74 62.42 5.62 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.484 2.123 . . . . 10.0 111.793 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -130.98 -178.24 4.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.915 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.574 ' HB2' HE22 ' B' ' 118' ' ' GLN . 1.2 t0 -90.35 177.69 6.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.873 0.368 . . . . 10.0 111.82 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 12.7 m -107.36 132.73 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.675 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' GLY . . . . . 0.498 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -85.15 -150.59 13.05 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.984 -0.627 . . . . 10.0 113.133 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.02 -41.76 11.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.002 0.429 . . . . 10.0 111.295 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.5 m -79.91 166.12 21.97 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.684 -179.326 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -73.55 127.9 34.01 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.0 t30 74.97 13.96 3.26 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.613 0.571 . . . . 10.0 110.954 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.498 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 28.4 tt0 -85.84 121.61 28.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -106.4 146.06 30.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.081 0.467 . . . . 10.0 111.545 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -119.1 105.4 11.36 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.238 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.34 127.23 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.537 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' GLN . . . . . 0.574 HE22 ' HB2' ' B' ' 107' ' ' ASP . 21.0 mp0 . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.091 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.918 0.389 . . . . 10.0 110.729 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.661 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -109.12 119.07 38.42 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.056 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 16.7 mt -96.18 117.84 31.55 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 179.177 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mp -103.63 113.2 39.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.791 0.329 . . . . 10.0 110.222 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.8 p -83.26 176.24 9.3 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.875 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.1 m -72.04 -7.06 46.66 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -93.82 -2.38 53.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.045 0.45 . . . . 10.0 109.832 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.71 9.7 80.65 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 10.0 111.867 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.12 123.09 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.676 0.274 . . . . 10.0 110.627 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.661 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 14.4 mt-10 -94.87 114.48 26.35 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.686 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 94.7 m-85 -104.07 107.08 17.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.598 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 10.8 mm -89.4 114.89 28.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.627 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.1 t -103.63 128.23 57.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.424 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -60.06 134.13 56.75 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.629 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 66.1 ttt180 -57.52 -28.81 63.81 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -55.51 -38.16 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.913 0.387 . . . . 10.0 111.139 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -95.09 -26.38 16.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.304 0.573 . . . . 10.0 110.148 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 18' ' ' ALA . . . . . 0.629 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -64.26 -33.51 75.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.632 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 75.2 mt -58.39 -51.5 69.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.229 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.548 ' O ' HG13 ' C' ' 24' ' ' ILE . 24.0 m -65.47 -41.26 93.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.432 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 24.3 m -58.39 -41.68 85.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.857 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.32 -15.36 81.21 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.982 -0.628 . . . . 10.0 112.575 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 38.7 m -82.13 -31.86 30.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.008 0.432 . . . . 10.0 110.166 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 24' ' ' ILE . . . . . 0.548 HG13 ' O ' ' C' ' 20' ' ' THR . 22.1 mt -69.87 158.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.205 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -71.4 87.03 0.85 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.078 0.466 . . . . 10.0 110.988 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -107.24 166.01 10.95 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.167 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.0 mmm -79.03 42.91 0.49 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.937 0.347 . . . . 10.0 111.937 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.34 -18.18 60.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.221 0.534 . . . . 10.0 110.427 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 15.9 m -101.05 14.59 31.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.85 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.97 -61.18 5.42 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.105 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.48 161.06 21.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.28 1.987 . . . . 10.0 111.968 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.71 23.82 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.943 -0.571 . . . . 10.0 112.621 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -127.27 113.56 16.46 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.939 0.4 . . . . 10.0 111.398 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -91.27 94.42 9.53 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.8 172.28 9.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -63.5 -14.93 55.94 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.593 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -55.78 22.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.775 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.414 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.6 tp10 -67.24 -31.64 72.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.939 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -62.57 -24.26 67.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.034 0.445 . . . . 10.0 111.034 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.37 -53.43 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.278 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -128.09 105.26 8.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.841 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.414 HG22 ' O ' ' C' ' 38' ' ' GLU . 4.1 t -84.22 121.59 36.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.796 0.331 . . . . 10.0 110.737 -179.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -90.39 103.82 16.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.71 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -98.19 112.88 24.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.182 0.515 . . . . 10.0 111.533 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -106.12 144.21 33.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 67.69 22.1 9.08 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.752 0.657 . . . . 10.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.2 mt -128.36 107.97 19.34 Favored Pre-proline 0 C--O 1.237 0.396 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.664 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -63.46 148.14 92.81 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.966 2.444 . . . . 10.0 111.837 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.1 p -59.76 -39.62 85.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.511 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 50' ' ' HIS . . . . . 0.464 ' CE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -53.57 -58.56 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 113.006 0.743 . . . . 10.0 113.006 -179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.408 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.3 m -62.71 -36.67 76.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 10.0 111.324 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 27.0 tp -64.09 -36.06 82.78 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.691 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 19.9 m -63.0 -40.6 98.26 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.292 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -66.79 -37.27 84.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.395 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.408 HG23 ' O ' ' C' ' 51' ' ' VAL . 89.6 t -62.26 -47.26 93.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.779 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -61.24 -39.2 89.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.838 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.0 mtm -65.01 -42.24 94.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.045 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -67.11 -39.79 86.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.416 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.512 ' O ' HG23 ' C' ' 63' ' ' VAL . 1.4 m-85 -60.89 -48.81 80.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.163 -0.472 . . . . 10.0 109.899 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 25.7 m -59.16 -40.92 87.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.214 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.579 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 27.8 t80 -64.01 -43.08 96.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.455 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -66.61 -34.22 77.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.166 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.512 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.1 t -62.17 -46.4 96.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -74.57 -38.05 62.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.804 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 12.8 t80 -58.59 -52.17 66.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.677 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -83.76 42.01 0.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.218 0.532 . . . . 10.0 110.539 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -152.77 -62.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.583 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.62 -36.02 1.45 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.909 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 20.4 m -82.5 43.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 111.932 -179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 -5.01 48.91 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.603 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -92.0 -7.8 47.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.029 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 pt -102.38 161.9 21.89 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.467 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -65.67 164.48 26.44 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.749 2.3 . . . . 10.0 112.534 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.4 168.25 11.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.273 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -51.19 131.32 32.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 122.314 0.246 . . . . 10.0 110.971 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.5 124.45 15.18 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.131 2.554 . . . . 10.0 112.313 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.3 pt -83.64 45.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 10.0 111.231 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.624 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.22 -53.91 0.19 Allowed Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.956 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.624 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 14.8 Cg_exo -69.72 98.87 0.71 Allowed 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.062 1.841 . . . . 10.0 110.725 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 18' ' ' LYS . 44.3 mt-10 -68.69 3.61 1.81 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.042 0.756 . . . . 10.0 113.042 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 81' ' ' ILE . . . . . 0.488 ' HA ' ' OE1' ' C' ' 84' ' ' GLU . 20.2 mm -77.66 -2.94 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.522 0.677 . . . . 10.0 110.625 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.5 -28.94 67.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.622 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 18' ' ' LYS . 8.8 tp -77.51 -22.58 50.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.861 0.362 . . . . 10.0 110.846 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.488 ' OE1' ' HA ' ' C' ' 81' ' ' ILE . 9.1 mp0 -64.79 -26.14 68.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 10.0 109.651 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 mt -75.91 -27.31 57.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.703 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 9' ' ' GLN . 0.5 OUTLIER -68.65 -20.99 64.48 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.437 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.6 -23.62 67.46 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.915 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 88' ' ' ALA . . . . . 0.661 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -57.98 -44.35 87.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.347 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.82 -58.57 0.39 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -78.59 19.64 0.48 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.999 0.37 . . . . 10.0 111.999 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.661 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 81.1 m-85 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.98 -0.533 . . . . 10.0 109.638 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.489 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 111.801 -0.52 . . . . 10.0 111.801 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.575 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -57.82 -59.72 4.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.651 0.612 . . . . 10.0 112.651 -179.229 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.693 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.5 tp -65.66 -37.38 86.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.461 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -58.25 -24.5 59.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.146 0.498 . . . . 10.0 111.101 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -98.85 -46.78 5.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.104 0.478 . . . . 10.0 110.496 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.579 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 97.1 mt -63.43 -34.83 78.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.06 92.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.727 0.299 . . . . 10.0 111.324 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.3 tp -68.14 -28.85 67.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.522 . . . . 10.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.56 -10.29 59.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.283 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.3 -36.04 10.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.21 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.605 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.2 tp -151.1 121.72 7.46 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.265 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 mp -86.63 92.62 3.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.68 -0.859 . . . . 10.0 108.68 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' C' ' 83' ' ' LEU . 81.1 tttt -106.28 105.9 55.54 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.006 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -98.0 64.68 0.09 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.386 2.724 . . . . 10.0 110.802 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -124.8 170.84 10.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.018 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -77.44 145.49 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.529 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.881 HD11 HD23 ' C' ' 83' ' ' LEU . 44.2 mm -116.28 99.61 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.219 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.833 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 40.9 tttp -104.92 142.05 23.84 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 107.662 -1.236 . . . . 10.0 107.662 178.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -36.1 130.92 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.586 2.858 . . . . 10.0 112.912 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.805 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 10.6 Cg_endo -52.93 137.66 61.37 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.568 2.845 . . . . 10.0 113.165 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 125.08 83.31 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.252 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.95 -15.58 48.56 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.08 2.52 . . . . 10.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.19 -35.08 79.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.464 -0.335 . . . . 10.0 111.181 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -130.0 -127.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 109.996 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.506 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 4.9 ptp180 -155.22 52.29 0.61 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.136 0.493 . . . . 10.0 111.02 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -149.17 151.36 34.2 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.805 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -74.74 148.47 40.43 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.124 -0.324 . . . . 10.0 110.124 178.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.527 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -84.92 155.17 21.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.369 -179.466 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -107.59 110.82 22.8 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.833 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 21.7 t70 -162.43 -77.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.55 -69.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.731 -1.128 . . . . 10.0 109.397 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mmm . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.758 0.313 . . . . 10.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.3 141.16 35.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.119 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.417 HG11 HD13 ' B' ' 57' ' ' LEU . 79.6 t -117.06 116.08 50.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.096 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.67 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 56.4 m-85 -104.08 114.75 29.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.346 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.562 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.1 pt? -134.27 158.33 44.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.878 0.37 . . . . 10.0 111.445 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.585 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.8 mtm -125.94 117.03 22.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.418 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.4 mm -87.49 112.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -108.92 109.3 20.34 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -99.81 73.77 1.8 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.388 -1.338 . . . . 10.0 107.388 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.604 ' HB2' HG12 ' B' ' 90' ' ' ILE . 6.9 t-160 66.63 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.362 -0.835 . . . . 10.0 111.18 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -108.91 -24.55 11.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.947 0.404 . . . . 10.0 110.905 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.4 m -86.06 107.77 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.89 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -110.66 123.47 50.07 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.423 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.794 HG12 HD12 ' C' ' 12' ' ' ILE . 20.5 mt -118.72 122.19 68.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.758 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' PHE . . . . . 0.512 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 52.6 t80 -79.84 121.68 25.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.562 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.2 m -112.11 118.36 35.17 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 10.0 111.607 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.874 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.0 t70 -104.09 93.58 4.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.155 -1.054 . . . . 10.0 108.155 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.2 -167.95 1.36 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.479 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -127.58 166.37 18.16 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -62.61 -23.12 66.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.892 0.377 . . . . 10.0 111.6 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.98 -9.58 59.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.716 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 3.7 m -81.19 142.81 32.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.69 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 57.7 p -92.21 169.6 10.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.617 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.4 t -69.7 -34.9 63.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.089 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -63.57 -35.05 79.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.349 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -62.17 -36.14 80.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.764 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.671 HD11 HD21 ' B' ' 57' ' ' LEU . 84.6 mt -60.87 -45.36 94.86 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -60.46 -40.03 89.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.053 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -62.66 -41.08 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.572 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -66.79 -47.8 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.271 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -61.6 -36.53 73.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 10.0 110.53 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.721 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.2 OUTLIER -60.51 -36.41 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.029 179.451 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.98 -5.88 89.37 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 121.063 -0.589 . . . . 10.0 112.791 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 69.4 mt -107.48 -50.2 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.792 0.33 . . . . 10.0 110.81 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 30.5 mt -87.14 -9.58 54.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 10.0 111.767 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.03 50.15 12.58 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.503 0.502 . . . . 10.0 111.474 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.58 142.25 31.11 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.512 -179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.85 128.83 16.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.498 2.799 . . . . 10.0 113.102 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.721 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 60.0 Cg_endo -71.86 -24.94 20.56 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 123.027 2.485 . . . . 10.0 112.743 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 t0 -68.99 -23.05 64.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.933 0.397 . . . . 10.0 111.038 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -90.7 -2.99 57.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.592 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -88.85 135.8 33.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.955 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.518 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 60.3 mmt-85 -125.46 110.81 14.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.217 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 90.4 mt -91.79 120.79 32.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.881 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -114.36 118.69 34.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.081 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.471 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 47.4 tttm -123.06 130.56 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.901 -0.777 . . . . 10.0 108.901 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 61.23 33.76 19.02 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.068 0.461 . . . . 10.0 110.242 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 65.55 21.89 11.76 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.477 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -130.78 149.15 52.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.781 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.471 HD11 ' HD2' ' B' ' 43' ' ' ARG . 48.1 tp -78.13 131.42 37.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.733 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -80.15 150.76 30.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.504 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.71 124.37 39.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.817 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.22 -33.6 65.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.41 -22.49 67.4 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.821 -0.704 . . . . 10.0 113.81 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.11 157.77 23.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.245 0.545 . . . . 10.0 111.796 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 26.3 p -94.19 167.49 11.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.467 178.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.671 HD21 HD11 ' B' ' 27' ' ' LEU . 43.9 mt -59.08 -43.16 91.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.764 0.316 . . . . 10.0 111.724 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.52 -35.44 72.79 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.952 -0.642 . . . . 10.0 113.061 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -79.4 -17.83 53.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.809 0.337 . . . . 10.0 111.298 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.3 m -90.47 6.57 42.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.649 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.22 16.64 53.12 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.565 -0.826 . . . . 10.0 112.716 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 44.3 m-85 -92.04 90.31 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.837 0.351 . . . . 10.0 110.145 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 39.4 p -116.02 176.83 4.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' B' ' 68' ' ' ARG . 0.7 OUTLIER -69.99 -0.13 6.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 10.0 111.592 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -95.0 -51.14 4.79 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.861 0.362 . . . . 10.0 110.241 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.99 -25.46 43.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.931 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.67 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -119.25 95.88 4.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.135 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' B' ' 64' ' ' SER . 26.9 mtm180 -119.0 156.79 51.85 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.767 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.401 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 31.9 Cg_endo -65.32 -15.14 48.61 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.419 2.079 . . . . 10.0 111.228 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.45 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -101.39 -7.48 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.605 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.647 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.84 92.08 1.56 Allowed Pre-proline 0 C--O 1.235 0.297 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.675 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.585 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.7 Cg_exo -80.56 130.28 7.79 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.904 2.403 . . . . 10.0 111.376 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.55 127.29 30.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.626 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m -85.78 127.18 34.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.056 0.455 . . . . 10.0 111.617 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.2 t -121.74 133.24 68.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.382 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.04 137.64 17.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.775 -0.726 . . . . 10.0 111.577 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 tp -116.89 109.63 17.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.071 0.463 . . . . 10.0 111.887 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.69 151.7 20.44 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -128.37 123.37 33.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.746 0.307 . . . . 10.0 110.808 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -74.64 89.18 2.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.177 0.513 . . . . 10.0 111.191 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -119.78 129.87 54.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.588 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.04 137.62 49.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.038 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 69.5 13.21 8.33 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.596 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.6 m -116.92 96.21 5.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.621 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.23 -8.83 57.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.708 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.459 ' O ' HG13 ' B' ' 90' ' ' ILE . 33.4 tt0 -60.11 -31.56 70.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.451 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.32 88.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.161 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.43 -21.6 64.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 16.2 m -84.04 -18.14 38.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.111 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.604 HG12 ' HB2' ' B' ' 10' ' ' HIS . 43.4 mt -91.48 -29.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.856 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.58 116.06 23.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.217 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.452 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.79 -14.36 44.24 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.004 2.469 . . . . 10.0 111.953 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -91.86 -15.61 27.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 10.9 m -103.17 -30.94 10.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.885 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 69.2 m -148.68 147.1 23.74 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.6 138.78 50.88 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.311 2.008 . . . . 10.0 111.282 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.92 125.42 8.25 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.217 2.611 . . . . 10.0 111.75 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -56.09 113.46 1.54 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.634 -0.712 . . . . 10.0 111.873 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.2 tp -143.87 125.41 8.16 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.419 -0.809 . . . . 10.0 109.279 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 24.9 Cg_exo -64.83 123.72 12.07 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.8 2.333 . . . . 10.0 111.997 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -63.21 -30.28 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.176 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -66.77 -14.01 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.297 0.57 . . . . 10.0 110.116 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 78.4 mmm -123.08 34.8 5.03 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.606 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 30.3 tttm -105.6 -49.1 0.12 Allowed Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 113.029 0.752 . . . . 10.0 113.029 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.606 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 70.1 Cg_endo -73.67 63.02 4.71 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.0 1.8 . . . . 10.0 112.688 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.531 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 39.1 mt-30 -133.6 150.31 51.61 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.092 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.74 148.98 45.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.584 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.8 m -76.17 141.52 41.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.979 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -84.88 -144.15 6.66 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.52 -37.04 12.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.119 0.485 . . . . 10.0 110.658 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.647 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 66.4 m -80.65 161.94 24.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.671 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.83 126.68 28.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.016 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 66.06 14.71 9.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.064 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 31.3 tt0 -76.43 136.2 39.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.799 0.333 . . . . 10.0 110.176 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -115.37 144.41 43.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.812 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -130.33 113.15 14.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.007 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.531 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -76.39 126.33 36.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.44 -0.346 . . . . 10.0 110.392 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.474 -0.33 . . . . 10.0 111.534 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.065 0.46 . . . . 10.0 111.321 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.559 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -118.07 115.93 25.84 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.766 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.6 mt -87.8 124.33 33.51 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.774 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 15.4 mt -107.61 113.07 42.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -83.82 166.26 18.1 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.653 -0.249 . . . . 10.0 111.019 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -68.69 -10.52 56.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.493 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -84.48 -11.84 55.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.157 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.98 28.46 20.83 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.147 -0.781 . . . . 10.0 111.147 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -106.46 133.09 51.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.171 -0.307 . . . . 10.0 110.171 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.559 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 25.2 mt-10 -98.2 129.82 44.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.354 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -123.23 101.12 7.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.68 0.276 . . . . 10.0 110.634 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.794 HD12 HG12 ' B' ' 14' ' ' ILE . 45.3 mt -94.06 125.62 46.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 4.5 t -107.64 148.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.904 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.874 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 58.2 tttt -59.56 138.18 57.78 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.119 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -51.56 -43.73 62.49 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.277 0.473 . . . . 10.0 112.277 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.569 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.5 tt0 -56.84 -52.17 66.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.396 . . . . 10.0 111.51 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -65.79 -41.29 92.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.775 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.87 96.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.398 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 65.7 mt -62.6 -48.24 80.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.71 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 8.7 m -60.74 -41.16 94.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 36.4 m -67.59 -31.72 71.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.429 . . . . 10.0 110.561 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.79 -9.84 83.2 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.932 -0.651 . . . . 10.0 112.151 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -84.03 -17.97 38.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.055 0.455 . . . . 10.0 110.109 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.8 mt -80.3 157.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.674 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -73.34 78.1 1.36 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.201 0.524 . . . . 10.0 110.524 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.575 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -94.58 170.75 9.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.458 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.489 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 92.2 mmm -78.34 31.41 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.249 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mp -68.59 -26.12 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.158 0.504 . . . . 10.0 110.503 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 7.6 m -95.71 15.73 19.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.199 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.0 -61.31 3.8 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.378 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.82 166.61 15.6 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.713 2.275 . . . . 10.0 111.464 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.03 -66.64 2.71 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.31 -0.471 . . . . 10.0 113.551 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -126.05 120.9 31.45 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 122.39 -0.476 . . . . 10.0 111.415 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -95.65 90.96 5.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.35 166.6 22.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.702 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -63.8 -33.97 76.86 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -63.53 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.759 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.461 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.1 mp0 -72.69 -24.0 60.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.432 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -80.3 -19.26 47.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.26 0.552 . . . . 10.0 109.929 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -94.09 -59.95 1.85 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.979 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -105.83 89.18 3.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.087 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.461 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.4 t -84.89 94.66 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.109 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 43' ' ' ASN . . . . . 0.403 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 21.0 t-20 -82.18 119.12 23.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.049 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -104.56 124.16 48.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.545 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -105.08 140.5 38.16 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.934 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 69.52 19.78 7.37 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.878 0.736 . . . . 10.0 111.011 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -127.04 107.5 21.92 Favored Pre-proline 0 C--O 1.236 0.389 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.98 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.506 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 27.5 Cg_exo -64.97 158.75 49.82 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 123.269 2.646 . . . . 10.0 112.13 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -67.37 -41.52 84.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.266 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -57.41 8.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.518 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.509 ' HB ' HD21 ' C' ' 85' ' ' LEU . 32.4 m -65.56 -35.25 74.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.674 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -66.66 -34.69 78.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -60.16 -42.92 95.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.73 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 46.8 tttp -65.9 -35.18 79.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.458 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.441 HG23 ' O ' ' C' ' 51' ' ' VAL . 66.8 t -65.41 -44.57 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.736 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 54.8 m -61.18 -42.65 98.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.687 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.4 mtm -66.63 -38.91 87.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.726 179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.579 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.9 t80 -62.09 -43.84 97.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.587 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.3 m-85 -65.13 -43.35 92.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.262 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 75.3 m -57.85 -43.78 86.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.415 0.626 . . . . 10.0 109.584 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' B' ' 70' ' ' GLN . 14.0 t80 -67.07 -42.8 84.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.133 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -59.97 -39.12 84.53 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.232 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.421 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -59.4 -50.08 81.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.004 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.1 mmt180 -71.96 -37.24 69.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.653 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 83.3 t80 -59.03 -42.36 90.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.965 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.6 13.65 15.36 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.758 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -117.2 -56.34 2.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.331 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.12 -20.44 0.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.611 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 13.7 m -84.15 27.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.127 0.489 . . . . 10.0 111.512 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 -11.2 59.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.278 0.561 . . . . 10.0 110.128 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -77.42 -22.63 51.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.326 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.744 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 37.0 pt -100.37 165.88 13.63 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.031 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.744 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 58.6 Cg_endo -71.11 171.2 16.38 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.306 2.004 . . . . 10.0 113.241 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.64 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 5.9 tp10 -71.51 173.68 7.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.147 -0.933 . . . . 10.0 108.904 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.64 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 17.5 t80 -54.01 130.26 58.27 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 76' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 73.1 Cg_exo -51.71 131.79 38.95 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.135 2.557 . . . . 10.0 112.914 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.605 HG22 ' HA ' ' A' ' 16' ' ' LEU . 16.7 pt -84.14 37.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.915 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.439 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -90.18 -54.58 0.29 Allowed Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.55 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.439 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 34.6 Cg_endo -65.49 116.94 4.19 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.758 1.639 . . . . 10.0 111.681 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -69.58 -2.39 11.36 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.44 94.9 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.221 0.534 . . . . 10.0 110.452 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.502 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -161.51 -42.46 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.619 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.881 HD23 HD11 ' A' ' 22' ' ' ILE . 8.4 tp -68.43 -24.85 64.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.687 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 26.9 mp0 -63.27 -35.64 81.01 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.887 -1.051 . . . . 10.0 108.946 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.693 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -78.97 -34.36 44.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.264 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.421 HD13 HD12 ' C' ' 83' ' ' LEU . 5.4 tt -64.46 -30.23 71.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.221 -0.9 . . . . 10.0 110.034 179.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 29.0 ttp -62.53 -18.16 61.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.44 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.56 83.06 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.593 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.94 -51.67 0.53 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.453 0.908 . . . . 10.0 113.453 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -78.81 13.54 1.66 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.878 0.371 . . . . 10.0 111.49 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.876 0 CA-C-O 118.786 -0.626 . . . . 10.0 109.435 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 CA-C-O 120.196 -0.224 . . . . 10.0 112.916 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.58 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.18 -67.37 0.4 Allowed 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.871 0.323 . . . . 10.0 111.871 -179.374 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.631 HD23 ' HB3' ' C' ' 85' ' ' LEU . 9.4 mp -63.87 -34.79 78.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 10.0 110.392 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -52.45 -34.97 51.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.694 -0.685 . . . . 10.0 111.185 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -100.32 -40.77 7.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.566 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.505 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 79.7 mt -64.18 -39.86 94.88 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.064 0.765 . . . . 10.0 113.064 -178.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.31 -30.64 69.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.628 0.252 . . . . 10.0 111.382 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.4 -32.58 73.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.151 0.5 . . . . 10.0 110.192 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.65 56.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.553 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.04 -26.63 15.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.761 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.9 OUTLIER -164.93 118.99 1.29 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.644 179.684 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.3 mt -86.02 97.03 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.544 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 76.8 tttt -113.29 97.01 41.65 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.186 -178.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -88.22 59.14 2.88 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.854 2.369 . . . . 10.0 111.631 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.544 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 34.3 mttm -111.66 177.31 4.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.786 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -81.06 151.97 28.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.719 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.413 HD11 ' CD2' ' C' ' 83' ' ' LEU . 44.9 mm -116.05 110.79 32.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.143 0.497 . . . . 10.0 111.351 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -126.87 137.38 30.43 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.642 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 18.1 Cg_exo -32.7 137.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 124.27 3.313 . . . . 10.0 114.297 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.763 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.4 Cg_endo -58.87 131.13 40.17 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.056 2.504 . . . . 10.0 112.217 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' H ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -71.72 123.21 89.08 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.643 179.772 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 -9.2 21.76 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.995 2.463 . . . . 10.0 111.876 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -31.63 72.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.103 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 ' HG2' ' A' ' 30' ' ' ARG . 14.0 t -134.78 -100.06 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.609 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.1 ptp180 176.81 53.66 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.191 0.597 . . . . 10.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 tttm -149.52 149.19 30.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.45 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.763 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.4 159.6 33.72 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.931 0.396 . . . . 10.0 110.861 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -108.83 179.47 4.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.874 -179.202 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.424 ' H ' HG22 ' A' ' 33' ' ' THR . 41.5 mt-10 -124.6 130.2 51.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.84 0.352 . . . . 10.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.7 OUTLIER -168.37 -74.08 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.632 179.568 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.439 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.07 -56.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.851 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.621 -0.704 . . . . 10.0 110.261 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.7 tmm? . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 120.976 0.417 . . . . 10.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.0 143.29 31.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.346 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -127.49 118.31 49.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 120.992 0.425 . . . . 10.0 110.264 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.526 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 62.4 m-85 -105.37 113.09 26.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.45 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.541 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -128.38 156.99 42.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.809 0.338 . . . . 10.0 111.354 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.498 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 64.6 mtm -125.21 108.37 11.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.529 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.504 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.4 mm -81.33 104.34 9.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.419 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -100.49 102.04 13.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.522 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 29.7 ttp85 -89.25 65.8 7.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.535 ' HB2' HG12 ' B' ' 90' ' ' ILE . 9.1 t-160 68.73 -77.94 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.145 -0.934 . . . . 10.0 110.645 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -108.54 -15.81 14.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.986 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -97.56 99.35 10.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.243 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -98.17 113.68 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.738 0.304 . . . . 10.0 110.561 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.5 mt -108.36 119.2 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.909 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' PHE . . . . . 0.526 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 76.1 t80 -80.66 124.24 28.84 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.815 -0.439 . . . . 10.0 109.815 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.541 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -117.93 122.28 42.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.041 0.448 . . . . 10.0 112.093 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.861 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.7 t70 -104.47 99.25 8.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.818 -1.178 . . . . 10.0 107.818 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.55 -167.89 1.6 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.844 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -123.45 160.39 27.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.22 -26.72 67.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.956 0.408 . . . . 10.0 111.954 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.89 -10.75 59.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.983 -0.553 . . . . 10.0 112.062 -179.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 17.8 m -72.86 143.16 47.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 10.7 p -90.37 157.91 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.722 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -60.72 -36.75 73.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 10.0 111.165 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.9 -30.59 70.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.833 179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.18 -36.76 85.22 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.27 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.51 HD11 HD21 ' B' ' 57' ' ' LEU . 78.3 mt -61.23 -43.08 99.46 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.534 -0.543 . . . . 10.0 109.534 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -61.71 -38.52 88.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.168 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 61.9 mtp180 -65.87 -39.49 90.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.818 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 99.0 mt -65.96 -46.31 88.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.58 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 70.0 t -62.15 -38.1 80.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.753 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.816 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 2.2 tm-20 -61.54 -37.1 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.08 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.02 -4.35 77.53 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 120.972 -0.633 . . . . 10.0 112.895 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 84.4 mt -112.68 -54.03 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.725 0.298 . . . . 10.0 111.23 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.9 mt -82.39 -14.66 54.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.239 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 63.4 mttt 58.0 48.68 12.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.757 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -137.27 139.98 29.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.328 -0.851 . . . . 10.0 110.072 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -43.85 123.87 4.24 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.923 3.082 . . . . 10.0 113.665 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 39' ' ' PRO . . . . . 0.816 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.5 Cg_endo -71.4 -16.53 31.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.924 2.416 . . . . 10.0 111.848 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.69 -38.48 85.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.216 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.468 ' HA ' ' NH2' ' B' ' 43' ' ' ARG . 7.8 mm-40 -96.61 14.18 25.69 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -178.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.89 127.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.489 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 26.1 mmt-85 -112.95 108.23 17.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.567 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.3 mt -90.71 112.37 24.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.087 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' B' ' 93' ' ' PHE . 35.1 m-85 -108.06 117.38 34.0 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.546 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.7 tttm -132.23 138.33 47.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.301 -1.0 . . . . 10.0 108.301 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 63.39 27.98 15.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.446 0.466 . . . . 10.0 109.871 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 67.12 17.24 10.38 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.464 -0.789 . . . . 10.0 111.613 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -129.49 166.11 20.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.9 tp -89.91 130.54 36.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.577 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' B' ' 46' ' ' LYS . 82.9 mt -72.71 158.2 36.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.226 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.493 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 18.0 t0 -100.54 127.15 46.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.956 -179.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -66.24 -28.2 68.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.597 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.1 8.18 79.94 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.109 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 97.5 mttt -116.79 159.71 21.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.865 0.364 . . . . 10.0 110.817 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.2 p -92.06 170.47 9.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.613 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.536 ' O ' ' HB2' ' B' ' 62' ' ' PHE . 26.3 mt -62.72 -42.45 99.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.79 -33.8 69.06 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.165 -0.54 . . . . 10.0 112.589 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -80.03 -13.64 59.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.678 0.275 . . . . 10.0 111.572 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 59.9 m -99.62 16.27 23.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.949 0.404 . . . . 10.0 111.633 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.17 11.85 77.62 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.728 -0.748 . . . . 10.0 113.199 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 29.9 m-85 -86.84 96.86 10.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 117.061 0.431 . . . . 10.0 110.186 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 156.83 31.89 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 50.7 m -60.86 -22.28 64.1 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.183 0.438 . . . . 10.0 112.183 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -76.43 -37.36 57.14 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.812 0.301 . . . . 10.0 111.812 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -39.32 18.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.196 0.522 . . . . 10.0 109.674 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.56 82.1 1.99 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.283 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -89.67 157.76 46.22 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.029 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.28 -21.24 71.17 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.609 2.206 . . . . 10.0 111.819 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CG ' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.67 4.05 23.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.794 179.598 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.569 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -155.83 80.23 4.05 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.613 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.498 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.7 Cg_exo -74.7 144.83 31.92 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.889 2.392 . . . . 10.0 111.99 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 120.74 19.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.816 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.46 120.93 21.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.465 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.504 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.0 t -118.77 133.84 64.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.19 137.64 14.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.626 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.81 107.93 14.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.969 0.414 . . . . 10.0 111.578 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.489 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -103.55 138.83 39.7 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.183 -0.673 . . . . 10.0 109.183 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -114.79 121.75 44.25 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -74.57 82.87 2.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 10.0 111.849 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.21 122.32 43.97 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -66.01 145.88 55.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.338 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.93 24.79 14.74 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.875 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.3 m -132.09 112.34 12.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.207 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -69.82 -19.1 63.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.052 0.453 . . . . 10.0 111.198 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.8 tt0 -54.64 -33.2 60.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.217 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.55 -30.26 69.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.769 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 14.0 mt -92.18 -9.92 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.316 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 43.0 m -87.23 -35.62 18.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.917 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.535 HG12 ' HB2' ' B' ' 10' ' ' HIS . 3.6 mt -89.54 14.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.234 0.54 . . . . 10.0 110.825 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.94 103.85 46.41 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.548 ' HA ' ' O ' ' B' ' 95' ' ' SER . 18.8 Cg_exo -67.97 -3.86 11.36 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.338 2.692 . . . . 10.0 112.054 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.422 ' HB2' ' CE1' ' B' ' 45' ' ' TYR . 39.5 t80 -75.65 -27.62 58.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.998 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 68.7 m -124.31 -35.56 2.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.239 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.548 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 58.8 m -103.42 151.54 38.65 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.419 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.49 157.84 32.56 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.553 2.169 . . . . 10.0 111.441 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 132.87 31.43 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.268 1.979 . . . . 10.0 111.4 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -68.67 108.97 3.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.069 0.462 . . . . 10.0 111.424 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 19.2 tp -138.57 125.43 13.05 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.35 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.3 Cg_exo -60.75 135.01 57.25 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.81 2.34 . . . . 10.0 112.698 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.34 -38.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.971 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 m -68.24 -18.2 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.236 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.455 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.8 mmm -115.45 51.03 0.95 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.468 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.567 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 60.7 tttm -119.38 -53.87 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -179.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.567 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.8 Cg_exo -76.77 67.62 7.32 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.499 2.133 . . . . 10.0 111.903 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.577 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 56.0 mt-30 -133.4 162.15 32.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.517 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.499 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.8 t0 -79.91 178.03 8.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.021 0.438 . . . . 10.0 111.356 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.88 131.13 43.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.25 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.68 -153.37 15.46 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.95 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.36 -29.77 17.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.098 0.475 . . . . 10.0 110.739 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.4 m -93.74 159.68 15.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.83 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 112' ' ' ALA . . . . . 0.569 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -69.85 134.22 48.24 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.347 -0.982 . . . . 10.0 108.347 178.303 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.03 -5.96 2.08 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.566 0.541 . . . . 10.0 111.46 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.1 tt0 -74.16 127.34 32.7 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.845 0.355 . . . . 10.0 110.466 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -109.69 139.8 44.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 116' ' ' ALA . . . . . 0.499 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -99.62 101.93 13.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.361 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.577 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -70.5 109.24 2.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.101 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.445 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.699 0.285 . . . . 10.0 110.985 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -101.68 105.43 16.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.641 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 36.5 mt -91.1 113.44 25.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.808 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 33.3 mt -100.6 119.4 48.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -93.09 166.24 12.44 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.673 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -16.97 44.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -85.67 -3.77 58.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.799 0.333 . . . . 10.0 110.729 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.59 18.28 60.45 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.584 -0.817 . . . . 10.0 112.713 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 135.9 33.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -104.65 113.23 26.67 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.999 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.641 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 97.4 m-85 -102.87 113.02 26.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.692 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 22.3 mm -98.82 117.91 44.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -103.83 137.97 30.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.544 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.861 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 74.5 tttt -60.02 134.44 57.05 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -51.69 -43.6 62.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.854 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -51.89 -51.61 55.6 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.96 0.41 . . . . 10.0 111.744 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -74.22 -37.28 63.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.332 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.63 95.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.479 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.74 -49.6 77.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.815 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.407 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.1 m -63.15 -36.61 84.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.981 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.2 m -67.16 -33.14 74.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 10.0 110.407 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.1 -11.69 84.65 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.398 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 -18.26 47.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 10.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -83.75 160.53 3.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.394 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -73.74 86.43 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.136 0.493 . . . . 10.0 111.059 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.24 173.44 6.79 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.829 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.724 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 90.0 mmm -78.58 31.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.873 0.323 . . . . 10.0 111.873 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 tp -65.25 -31.99 73.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.568 . . . . 10.0 109.809 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.5 14.19 19.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.466 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.6 -60.29 5.51 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.865 -0.607 . . . . 10.0 113.185 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.91 179.76 2.56 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.345 2.03 . . . . 10.0 112.461 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.21 -55.44 18.7 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.289 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -142.13 121.29 12.99 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.784 -0.245 . . . . 10.0 110.824 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.91 91.24 5.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.6 159.83 26.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.047 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -60.58 -25.37 66.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.497 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.2 -35.1 71.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.073 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.05 -28.77 64.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.388 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.02 -16.11 60.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -85.12 -52.38 5.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.385 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -129.56 99.06 5.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.376 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -83.52 114.72 24.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.628 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -90.33 109.11 20.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.869 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -106.76 94.47 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 10.0 111.374 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 45' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 86.8 mtt180 -89.89 156.71 18.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 46' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 12.2 mm-40 70.95 16.6 6.47 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.234 0.54 . . . . 10.0 111.305 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 75.8 mt -130.15 117.94 18.19 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.708 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.574 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 24.6 Cg_exo -65.55 138.83 56.13 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.791 2.327 . . . . 10.0 111.806 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -59.95 -40.85 90.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -50.04 61.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.902 -0.59 . . . . 10.0 112.392 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.0 m -73.87 -27.4 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 120.942 -0.303 . . . . 10.0 111.593 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.86 -39.36 93.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.512 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -35.34 72.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.86 0.362 . . . . 10.0 110.791 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.14 -35.11 77.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.116 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.0 t -67.24 -47.44 81.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 35.9 m -59.56 -40.53 87.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.462 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -65.69 -42.51 91.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.849 179.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.505 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 71.6 t80 -65.44 -40.58 93.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.817 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.404 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.3 m-30 -61.7 -47.34 85.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.925 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.5 m -60.58 -42.21 96.23 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.972 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CG ' ' HB3' ' B' ' 70' ' ' GLN . 21.2 t80 -62.86 -42.53 99.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.325 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -64.13 -37.54 87.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.167 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.407 HG22 ' HB ' ' C' ' 20' ' ' THR . 54.2 t -61.82 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.006 0.431 . . . . 10.0 110.089 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.2 mmt180 -72.79 -42.31 64.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.185 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.494 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 88.7 t80 -57.25 -48.44 78.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 50.06 1.7 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.208 0.528 . . . . 10.0 110.771 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -162.16 -58.44 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.297 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -130.1 -36.92 1.5 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.981 0.42 . . . . 10.0 111.647 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.494 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 11.2 m -83.9 37.22 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.68 8.09 23.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.5 0.667 . . . . 10.0 109.694 179.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -99.52 -2.34 36.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.523 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.71 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 42.1 pt -115.91 166.54 12.09 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.71 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 73.4 Cg_endo -75.57 172.36 16.47 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.371 2.047 . . . . 10.0 112.718 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.56 170.32 9.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.036 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 57.2 t80 -53.94 130.63 57.96 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.766 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 76' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 52.8 Cg_exo -54.07 118.62 5.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.994 2.463 . . . . 10.0 112.197 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' ' 16' ' ' LEU . 22.9 pt -81.18 42.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.657 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -89.32 -59.47 0.25 Allowed Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 58.0 Cg_endo -72.09 111.16 3.11 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.707 1.604 . . . . 10.0 111.365 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.549 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.52 56.37 2.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.681 -178.84 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 3.9 mm -120.08 9.8 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.465 0.65 . . . . 10.0 110.549 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -88.28 -26.03 22.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.095 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.472 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 tp -70.87 -27.58 63.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.069 0.461 . . . . 10.0 109.816 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.471 ' HA ' HD23 ' A' ' 32' ' ' LEU . 15.0 mp0 -61.39 -31.65 71.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.668 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.631 ' HB3' HD23 ' A' ' 8' ' ' LEU . 27.5 mt -77.5 -35.99 53.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.349 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.2 -23.81 65.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.579 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 87' ' ' MET . . . . . 0.443 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 38.6 ttp -57.49 -26.95 62.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.27 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.59 -30.85 71.64 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.57 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.87 -65.54 0.28 Allowed 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -82.9 36.56 0.5 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.352 0.501 . . . . 10.0 112.352 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.724 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 12.2 m-85 . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.128 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.685 -0.166 . . . . 10.0 112.685 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -63.74 1.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -179.097 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' C' ' 85' ' ' LEU . 11.1 tp -62.74 -27.93 69.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.501 -179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.546 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 5.7 mt-30 -58.98 -26.86 64.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.349 0.595 . . . . 10.0 110.765 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -105.01 -38.73 6.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.199 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.515 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 85.8 mt -62.86 -38.8 92.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.406 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.33 84.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.682 0.277 . . . . 10.0 110.802 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 tp -67.49 -27.73 67.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.366 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.02 -17.98 44.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.157 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.8 -48.83 6.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.603 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HA ' HG22 ' C' ' 77' ' ' ILE . 1.4 tp -149.8 124.63 9.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.407 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -95.73 93.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.112 -0.699 . . . . 10.0 109.112 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' CD ' ' HB2' ' C' ' 80' ' ' GLU . 28.1 ttpt -98.01 116.75 65.61 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.226 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -90.83 38.18 0.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.951 2.434 . . . . 10.0 111.972 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.421 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 57.2 mttm -94.95 166.58 11.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.237 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -79.03 154.84 29.15 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.597 HD11 HD23 ' C' ' 83' ' ' LEU . 47.3 mm -118.41 105.93 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.06 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 39.5 tttp -122.75 143.46 40.25 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 23' ' ' LYS . 33.0 Cg_exo -29.6 130.07 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 124.557 3.505 . . . . 10.0 114.326 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.712 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.34 135.4 67.73 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.393 2.729 . . . . 10.0 113.026 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -74.66 128.33 85.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.839 179.794 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -68.95 -13.62 37.02 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.099 2.533 . . . . 10.0 112.986 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.06 -35.67 80.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.974 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -129.78 -122.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.995 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -160.2 58.09 0.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.19 0.519 . . . . 10.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.43 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.8 tttm -152.31 154.56 35.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.682 -0.69 . . . . 10.0 109.256 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.712 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -77.69 152.78 33.57 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.744 0.306 . . . . 10.0 110.536 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.552 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 2.5 m -87.34 149.22 24.65 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.231 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -105.11 99.71 9.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.851 0.358 . . . . 10.0 110.285 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.6 t70 -149.78 -74.76 0.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.148 -0.478 . . . . 10.0 109.959 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.69 -68.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 179.002 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.3 m0 . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.255 179.342 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.412 ' HA ' ' OE2' ' B' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.051 0.453 . . . . 10.0 110.334 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.51 132.36 35.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.707 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' VAL . . . . . 0.419 HG11 HD13 ' B' ' 57' ' ' LEU . 57.5 t -121.4 116.57 50.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.707 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.562 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.8 m-85 -107.35 113.24 26.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.759 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -128.01 158.4 38.0 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.866 0.365 . . . . 10.0 111.323 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.614 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 57.3 mtm -128.51 109.25 11.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.642 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.479 HD13 ' HB ' ' B' ' 75' ' ' VAL . 40.9 mm -83.51 110.14 17.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -107.86 108.1 19.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -91.69 71.48 5.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.593 -1.262 . . . . 10.0 107.593 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.574 ' HB2' HG12 ' B' ' 90' ' ' ILE . 8.5 t-160 67.19 -77.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.482 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 73.3 mmtt -110.27 -7.61 14.82 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -106.36 104.49 14.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.519 0.2 . . . . 10.0 111.394 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.5 m -101.04 118.08 36.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.783 0.325 . . . . 10.0 110.568 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.525 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.8 mt -110.86 123.85 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.743 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' PHE . . . . . 0.529 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 86.6 t80 -81.08 125.17 29.87 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.759 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -118.07 119.2 34.03 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.161 0.505 . . . . 10.0 111.6 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -104.91 101.55 11.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.318 -0.993 . . . . 10.0 108.318 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.72 -171.2 2.32 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.89 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -124.35 162.41 23.86 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.412 ' OE2' ' HA ' ' B' ' 1' ' ' MET . 56.2 mt-10 -61.11 -22.94 65.13 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.345 0.498 . . . . 10.0 112.345 -179.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -2.07 47.04 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -91.88 144.54 25.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.531 0.205 . . . . 10.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 32.3 p -93.31 167.31 11.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.078 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.593 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.5 t -66.3 -34.54 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.865 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -62.14 -36.37 81.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 10.0 110.357 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.66 -33.2 75.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.835 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.958 HD11 HD21 ' B' ' 57' ' ' LEU . 69.7 mt -63.39 -45.95 88.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 10.0 109.928 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.52 -32.54 73.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.529 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -64.79 -37.46 87.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.037 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -69.01 -44.48 81.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.44 -33.64 57.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.482 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' GLU . . . . . 0.544 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 29.7 tt0 -59.8 -34.22 72.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.96 -0.563 . . . . 10.0 111.058 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.7 -19.29 58.39 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.542 -0.837 . . . . 10.0 112.844 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.7 mt -89.24 -57.91 3.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 10.0 111.66 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 39.8 mt -91.86 -8.12 47.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.854 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 85.1 mttt 58.78 51.2 7.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.368 0.604 . . . . 10.0 110.817 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 25.5 mmt180 -125.02 133.65 25.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.052 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.37 125.57 19.25 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.928 2.418 . . . . 10.0 112.294 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.69 -21.84 73.04 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.225 2.616 . . . . 10.0 113.059 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -64.39 -33.23 75.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.1 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 12.7 mm-40 -94.14 -2.77 52.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.059 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -82.64 126.85 32.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.54 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 86.7 mmt-85 -120.02 110.86 17.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' B' ' 51' ' ' LEU . 54.0 mt -92.86 118.08 30.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.905 0.383 . . . . 10.0 111.062 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -112.98 117.57 32.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.724 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.504 ' HB3' HD21 ' B' ' 51' ' ' LEU . 14.4 tmtt? -128.99 137.69 51.5 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.317 -0.994 . . . . 10.0 108.317 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 66.28 27.25 10.21 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.514 0.509 . . . . 10.0 109.749 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 67.89 17.07 9.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.773 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -132.12 169.79 15.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 41.7 tp -85.24 135.07 34.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.955 0.407 . . . . 10.0 111.202 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' B' ' 46' ' ' LYS . 65.2 mt -79.0 150.23 32.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.532 179.325 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 14.7 t0 -92.19 113.64 25.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.0 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.593 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.4 m-20 -58.02 -28.01 64.08 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.651 0.611 . . . . 10.0 112.651 -179.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.64 -11.62 68.16 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.425 -178.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 59.4 mttp -95.29 153.74 17.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.968 0.413 . . . . 10.0 110.796 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 32.6 p -83.37 165.54 19.18 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.23 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.958 HD21 HD11 ' B' ' 27' ' ' LEU . 74.4 mt -58.35 -44.73 88.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.16 -33.07 64.04 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.451 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.57 -29.57 52.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.946 0.403 . . . . 10.0 111.086 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' CYS . . . . . 0.494 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 36.9 m -83.58 14.37 3.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 111.696 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 81.66 12.35 81.72 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 121.081 -0.581 . . . . 10.0 112.905 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.494 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 61.3 m-85 -87.79 85.7 7.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.003 0.43 . . . . 10.0 110.321 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 47.1 p -114.42 165.23 12.95 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.435 -0.58 . . . . 10.0 109.435 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 9.7 m -65.54 -5.15 7.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.897 0.379 . . . . 10.0 111.971 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -81.8 -46.35 14.31 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.233 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.31 -35.14 18.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.937 179.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.562 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -101.35 93.31 5.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.275 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -109.43 157.84 36.23 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.666 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.61 -17.17 58.7 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.402 2.068 . . . . 10.0 111.518 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.13 -5.76 21.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.507 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -157.54 89.48 2.44 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.723 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.614 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 4.6 Cg_exo -79.14 138.29 14.19 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.966 2.444 . . . . 10.0 111.941 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.67 117.45 8.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.533 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -80.1 125.59 30.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.086 0.47 . . . . 10.0 111.672 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.479 ' HB ' HD13 ' B' ' 7' ' ' ILE . 32.0 t -119.3 139.27 47.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.456 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.18 131.25 10.54 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.582 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.439 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 52.0 tp -109.64 99.36 8.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.873 0.368 . . . . 10.0 111.321 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.452 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.51 113.42 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 80.3 t80 -96.05 117.35 30.5 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.64 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -71.87 91.57 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.224 0.535 . . . . 10.0 111.221 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -99.64 129.96 45.83 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.19 129.88 41.7 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.38 19.86 11.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.624 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 2.0 m -117.08 112.96 21.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.853 0.359 . . . . 10.0 110.127 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -74.09 -6.37 47.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.127 0.788 . . . . 10.0 113.127 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.4 tt0 -62.91 -32.6 73.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.935 0.398 . . . . 10.0 111.341 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.95 -37.45 74.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.89 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.25 -15.27 61.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.928 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.92 -26.06 17.77 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.574 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.7 mt -84.11 -11.82 11.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 10.0 110.982 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -85.67 113.36 50.74 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.847 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.4 Cg_exo -66.68 -14.94 45.91 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.047 2.498 . . . . 10.0 111.827 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -74.0 -37.38 64.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.262 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -96.67 -44.86 6.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.817 0.341 . . . . 10.0 111.021 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.9 m -111.45 138.98 21.57 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.657 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.04 153.75 76.77 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.386 2.057 . . . . 10.0 111.519 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -52.51 126.85 22.07 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.036 2.491 . . . . 10.0 112.575 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -70.31 107.29 3.69 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.259 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 24.0 tp -138.77 126.74 13.64 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.91 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.9 Cg_exo -60.13 127.01 21.74 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.589 2.193 . . . . 10.0 111.778 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.66 -31.26 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.735 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 20.7 m -67.5 -14.67 18.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.683 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.5 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 79.9 mmm -114.51 10.69 16.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.129 0.49 . . . . 10.0 109.873 179.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 25.4 ttpt -78.27 -53.42 1.35 Allowed Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 112.834 0.679 . . . . 10.0 112.834 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.9 Cg_exo -76.93 71.43 6.2 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.474 2.116 . . . . 10.0 112.356 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.529 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 53.6 mt-30 -135.73 167.73 20.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.0 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.62 159.3 19.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.944 0.402 . . . . 10.0 111.735 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -82.82 138.22 34.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -93.64 -174.7 39.97 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 121.085 -0.578 . . . . 10.0 112.312 179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -33.18 67.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.992 0.425 . . . . 10.0 111.546 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.653 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.0 OUTLIER -85.25 159.55 20.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.166 -179.363 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.56 121.73 15.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.332 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.28 13.53 6.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.921 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.571 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.2 tt0 -73.36 128.66 36.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -106.4 130.42 54.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.799 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.97 107.81 16.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.352 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.529 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -72.05 126.7 33.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.085 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.3 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.022 0.439 . . . . 10.0 110.775 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.596 ' HD3' ' HG2' ' C' ' 41' ' ' GLU . 85.0 tttt -110.57 119.0 37.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.742 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.468 HD22 ' HE2' ' C' ' 44' ' ' PHE . 43.2 mt -99.92 129.83 46.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.058 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 37.4 mt -113.5 119.91 62.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.7 p -89.64 168.36 12.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.178 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -69.15 -16.57 63.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.825 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -81.05 -16.71 52.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.94 0.4 . . . . 10.0 110.542 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 98.7 13.25 41.32 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.409 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -90.82 130.37 36.79 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.821 -0.436 . . . . 10.0 109.821 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -98.7 134.3 41.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.106 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -124.31 123.25 39.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.675 0.274 . . . . 10.0 111.29 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.525 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 33.2 mm -102.14 114.56 41.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 t -97.63 141.43 15.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.414 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -61.8 121.97 14.2 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.42 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 37.5 ttt-85 -51.36 -39.91 58.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.764 0.653 . . . . 10.0 112.764 -178.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -58.37 -52.37 65.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.809 0.337 . . . . 10.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -68.46 -33.01 73.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.091 0.472 . . . . 10.0 110.49 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.82 88.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.688 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 85.2 mt -61.67 -45.28 94.7 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.883 -0.414 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.45 -38.64 91.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.975 178.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -65.53 -36.78 84.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.286 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.72 -8.49 81.77 Favored Glycine 0 C--N 1.33 0.209 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.334 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 18.7 m -81.36 -20.96 39.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.393 0.616 . . . . 10.0 109.578 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.7 mt -84.06 159.03 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.175 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -76.11 81.19 2.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.143 0.497 . . . . 10.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.28 -163.19 0.85 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.876 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 83.9 mmm -101.76 27.39 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.64 -0.254 . . . . 10.0 111.453 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.91 -36.45 84.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.265 0.555 . . . . 10.0 110.495 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.2 m -91.58 14.32 15.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.397 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -57.75 4.94 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-N 115.823 -0.626 . . . . 10.0 113.16 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.44 -160.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.686 2.258 . . . . 10.0 111.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.37 -110.64 0.16 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.78 -0.724 . . . . 10.0 112.285 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -86.69 123.97 32.44 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 122.753 -0.263 . . . . 10.0 110.612 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -101.25 74.99 1.6 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.005 0.431 . . . . 10.0 110.105 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.15 158.44 33.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.335 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.03 -27.77 63.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.03 -35.82 77.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.02 0.438 . . . . 10.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -84.87 -21.7 29.66 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.74 -0.663 . . . . 10.0 109.824 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.1 m -77.72 -40.11 42.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.517 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -68.0 -47.31 68.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.862 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.596 ' HG2' ' HD3' ' C' ' 2' ' ' LYS . 37.1 mt-10 -124.82 90.43 3.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.18 115.63 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.886 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -91.98 111.96 23.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.917 0.389 . . . . 10.0 110.804 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.468 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.8 m-85 -97.36 114.85 26.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.112 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' C' ' 45' ' ' ARG . 39.3 mtt180 -100.11 147.13 26.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.221 -0.445 . . . . 10.0 109.887 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 65.52 21.41 11.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.749 0.655 . . . . 10.0 110.839 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 90.0 mt -129.59 109.49 17.42 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-O 121.079 0.466 . . . . 10.0 111.131 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 38.1 Cg_exo -63.77 150.98 87.17 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.135 2.557 . . . . 10.0 112.13 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.2 p -64.99 -38.96 92.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.411 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -54.24 46.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.78 -0.645 . . . . 10.0 112.294 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 51' ' ' VAL . . . . . 0.443 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.3 m -67.81 -34.62 68.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.638 -0.255 . . . . 10.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.53 -37.93 89.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.62 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 53' ' ' SER . . . . . 0.433 ' O ' ' HG3' ' C' ' 57' ' ' MET . 40.8 m -58.05 -40.71 81.62 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.543 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -67.55 -35.59 79.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.567 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.4 t -64.26 -46.49 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.847 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.4 m -60.66 -39.49 88.58 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.158 -0.473 . . . . 10.0 110.628 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 57' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' C' ' 53' ' ' SER . 52.6 mtm -67.29 -41.45 85.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.334 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.515 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -62.11 -42.87 99.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.49 179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.4 m-85 -61.49 -47.2 86.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.266 179.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -61.06 -42.45 98.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.161 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.18 -44.82 90.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.078 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 tptt -59.93 -42.14 93.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.612 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 51.3 t -59.12 -50.94 77.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.313 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 64' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' C' ' 64' ' ' ARG . 9.5 mmt85 -66.9 -42.33 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.733 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.8 -43.75 85.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.231 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 15.88 14.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.115 0.484 . . . . 10.0 111.18 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 67' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 5.8 t30 -111.93 -59.24 2.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.173 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.43 -30.14 0.56 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.389 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 10.4 m -80.82 47.58 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.941 0.4 . . . . 10.0 111.59 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.56 4.61 53.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.602 0.715 . . . . 10.0 110.018 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -80.83 -26.03 37.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.05 -0.977 . . . . 10.0 109.656 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 72' ' ' ILE . . . . . 0.653 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 29.4 pt -96.15 167.28 12.69 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.787 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 73' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 97.9 Cg_endo -80.34 179.88 5.78 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.276 1.984 . . . . 10.0 112.574 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 74' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.6 tp10 -69.65 168.64 14.42 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.651 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.433 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 31.4 t80 -48.23 127.57 12.41 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 122.382 0.273 . . . . 10.0 111.624 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -48.46 128.15 17.26 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.657 2.905 . . . . 10.0 113.614 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.481 HG22 ' HA ' ' A' ' 16' ' ' LEU . 13.2 pt -83.08 50.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.383 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.514 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -100.2 -57.59 0.13 Allowed Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.514 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 54.7 Cg_endo -69.9 120.13 6.95 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.605 1.537 . . . . 10.0 111.098 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.425 ' HB2' ' CD ' ' A' ' 18' ' ' LYS . 4.5 pt-20 -71.44 -8.18 52.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mm -79.54 83.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.491 0.662 . . . . 10.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 -41.98 0.16 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.867 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.597 HD23 HD11 ' A' ' 22' ' ' ILE . 11.8 tp -68.1 -25.57 65.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.506 -0.77 . . . . 10.0 108.981 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 20.9 mp0 -61.17 -36.14 79.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.64 178.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.623 ' HB3' HD21 ' A' ' 8' ' ' LEU . 38.5 mt -74.56 -33.57 62.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.838 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 5.0 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.171 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 28.0 ttp -60.48 -20.98 61.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.672 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.02 -30.56 71.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.449 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.14 -61.68 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.4 41.74 0.63 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.251 0.548 . . . . 10.0 111.369 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.823 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.194 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.406 -0.278 . . . . 10.0 112.406 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' C' ' 25' ' ' LYS . 0.0 OUTLIER -63.07 -61.26 2.5 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.068 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.772 HD21 ' HB3' ' C' ' 85' ' ' LEU . 27.0 tp -62.89 -28.76 70.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.231 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -55.99 -29.7 60.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.489 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -104.89 -34.63 7.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.979 0.418 . . . . 10.0 110.661 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.618 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.8 mt -63.99 -40.82 97.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 10.0 112.0 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' C' ' 86' ' ' LEU . . . -67.49 -29.22 68.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.773 0.321 . . . . 10.0 111.058 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 tp -66.04 -34.88 79.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.332 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.74 -13.44 56.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.543 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.34 -42.11 13.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.239 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.946 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -158.95 116.77 2.84 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.24 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.485 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.5 mt -85.58 88.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.547 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 82.5 tttt -97.62 103.7 17.64 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.737 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.485 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 33.5 Cg_endo -91.57 72.73 0.8 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.248 2.632 . . . . 10.0 111.452 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -131.68 169.71 15.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.497 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -85.09 149.04 25.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.697 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mm -102.02 129.53 53.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.202 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 1.012 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.0 OUTLIER -134.04 145.16 54.55 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.228 -1.027 . . . . 10.0 108.228 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.661 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 45.7 Cg_exo -36.14 131.05 0.36 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.693 2.928 . . . . 10.0 112.678 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.887 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.9 Cg_endo -54.89 152.64 28.22 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 123.401 2.734 . . . . 10.0 113.233 -178.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 mt -74.44 117.99 66.4 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.837 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.15 -23.54 52.8 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.726 2.284 . . . . 10.0 112.287 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.26 61.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.63 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.3 t -108.07 -132.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.27 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.2 ptp180 -158.49 56.29 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 10.0 110.525 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.421 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.9 tttm -152.09 149.75 29.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.334 -0.848 . . . . 10.0 108.876 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.887 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -73.07 154.52 40.39 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.715 0.293 . . . . 10.0 111.108 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.6 m -93.29 165.7 12.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.162 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -113.62 127.74 56.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.592 0.234 . . . . 10.0 110.629 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 1.012 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.5 t70 -172.19 -79.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.795 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.84 -54.44 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 . . . . . 0 C--O 1.247 0.961 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.081 179.944 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmm? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 120.572 0.225 . . . . 10.0 111.482 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.15 115.5 1.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.75 122.11 63.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.272 0.558 . . . . 10.0 111.318 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.517 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 47.4 m-85 -108.13 105.25 14.9 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.629 179.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.845 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.4 OUTLIER -113.31 150.4 32.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.031 0.443 . . . . 10.0 111.499 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 6' ' ' MET . . . . . 0.539 ' HB2' ' HB2' ' B' ' 72' ' ' PRO . 38.5 ttm -120.91 101.36 7.64 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.47 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.65 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.5 mm -80.94 113.56 20.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -111.63 101.87 10.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.524 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 21.8 ttp85 -89.75 73.63 7.56 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' HIS . . . . . 0.75 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.7 t-80 65.09 -81.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.529 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -114.76 0.37 13.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.787 0.327 . . . . 10.0 111.603 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.524 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -106.72 100.03 9.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.158 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 50.2 m -93.89 127.51 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.866 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.616 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 55.5 mt -123.35 117.34 51.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.305 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -82.69 119.01 23.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' THR . . . . . 0.845 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -113.65 113.01 24.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.203 0.525 . . . . 10.0 112.16 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 17' ' ' ASP . . . . . 0.979 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 6.4 t70 -99.26 99.79 10.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.581 -1.266 . . . . 10.0 107.581 178.159 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.8 -166.18 1.56 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.517 -0.311 . . . . 10.0 111.288 -178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -128.03 158.21 38.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.842 -0.429 . . . . 10.0 109.842 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 5.5 mp0 -56.78 -31.03 64.24 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.365 0.505 . . . . 10.0 112.365 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -17.38 64.68 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 49.5 m -79.43 142.59 35.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.71 0.29 . . . . 10.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.2 p -90.47 167.11 12.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.798 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.417 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -65.12 -32.59 58.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.014 178.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.01 -38.07 89.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.064 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.95 -31.18 72.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.935 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.882 HD11 HD21 ' B' ' 57' ' ' LEU . 85.5 mt -64.85 -42.22 95.07 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.58 -36.12 79.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.648 -0.706 . . . . 10.0 110.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.03 -37.61 87.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.2 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -69.28 -47.8 71.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.538 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.23 -39.4 80.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.638 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -58.79 -38.29 78.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.377 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.25 -11.83 84.65 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.809 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 72.3 mt -103.22 -51.51 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.865 0.364 . . . . 10.0 111.474 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 41.2 mt -84.25 -16.0 44.79 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.494 0.553 . . . . 10.0 112.494 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 mttt 62.05 45.45 7.23 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.531 0.681 . . . . 10.0 110.609 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' B' ' 37' ' ' ARG . 53.4 mtt-85 -133.3 143.66 49.13 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.529 -0.76 . . . . 10.0 109.972 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.79 131.6 46.59 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.12 2.547 . . . . 10.0 112.755 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.05 -16.68 36.4 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.872 2.381 . . . . 10.0 112.036 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.64 -28.21 69.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.434 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -104.93 13.34 31.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.82 0.343 . . . . 10.0 111.812 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -92.48 127.68 38.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.865 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 43.1 mmt-85 -117.37 111.76 19.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.416 -0.357 . . . . 10.0 110.616 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.1 mt -95.97 113.64 25.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.556 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -109.45 115.96 30.92 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.236 0.541 . . . . 10.0 112.435 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -115.43 127.27 55.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.404 -0.816 . . . . 10.0 108.919 178.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 61.91 35.87 16.11 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.51 0.506 . . . . 10.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.15 9.11 7.21 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.394 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -119.7 160.33 22.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.142 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 tp -85.66 139.0 31.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.644 0.259 . . . . 10.0 110.882 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -79.51 170.72 16.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.882 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -112.88 120.47 41.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.945 0.402 . . . . 10.0 110.754 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 0.9 OUTLIER -64.04 -25.99 68.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.297 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.88 13.33 66.29 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.813 -0.708 . . . . 10.0 113.179 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.77 155.17 43.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.034 0.445 . . . . 10.0 111.349 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 24.8 p -87.25 168.58 13.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.166 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.882 HD21 HD11 ' B' ' 27' ' ' LEU . 51.3 mt -60.79 -39.66 89.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.838 0.351 . . . . 10.0 110.654 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.8 -27.71 67.09 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.851 -0.613 . . . . 10.0 112.623 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.0 -26.56 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.061 0.457 . . . . 10.0 110.782 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.0 m -82.46 2.78 31.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.846 -0.615 . . . . 10.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.22 15.95 59.88 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.906 -0.664 . . . . 10.0 113.018 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 41.3 m-85 -86.61 87.39 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.818 0.342 . . . . 10.0 110.789 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.2 p -108.8 170.26 8.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 33.9 m -70.62 -3.78 19.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.079 0.466 . . . . 10.0 111.113 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -88.36 -43.17 11.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -79.05 -30.45 44.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.073 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 67' ' ' ALA . . . . . 0.517 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -118.41 106.57 12.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.03 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.5 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 64.0 mtt180 -113.01 160.08 32.26 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.806 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 12.1 Cg_endo -55.85 -24.47 47.43 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.987 2.458 . . . . 10.0 113.025 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.487 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -115.55 12.97 16.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.707 0.289 . . . . 10.0 111.351 179.396 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -152.83 82.71 4.94 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.741 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.539 ' HB2' ' HB2' ' B' ' 6' ' ' MET . 4.3 Cg_exo -76.03 133.02 14.65 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.884 2.389 . . . . 10.0 111.726 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 114.7 5.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.41 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.56 125.1 26.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.11 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 75' ' ' VAL . . . . . 0.65 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.1 t -124.06 131.01 73.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.27 133.26 11.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.617 -0.801 . . . . 10.0 111.625 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.2 tp -114.7 108.51 16.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.0 0.429 . . . . 10.0 111.453 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.582 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -102.2 141.01 35.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.001 -0.741 . . . . 10.0 109.001 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -119.56 121.63 39.79 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -76.19 96.85 3.99 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.274 0.559 . . . . 10.0 111.456 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -115.43 120.89 41.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.224 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -57.93 132.5 53.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.962 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.28 4.34 4.5 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.369 -0.832 . . . . 10.0 112.693 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 108.79 20.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.11 0.481 . . . . 10.0 110.031 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -82.73 -7.98 59.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.804 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.473 ' O ' HG13 ' B' ' 90' ' ' ILE . 39.0 tt0 -58.45 -29.36 66.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.321 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.8 -38.96 79.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.446 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.04 -27.9 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.539 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 35.0 m -77.14 -26.94 53.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.955 0.407 . . . . 10.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.75 HG12 ' HB2' ' B' ' 10' ' ' HIS . 19.0 mt -88.2 -21.16 7.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.45 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 46.0 tt0 -76.23 112.56 21.61 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.92 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 92' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' B' ' 95' ' ' SER . 13.2 Cg_exo -71.63 -7.85 22.01 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.043 2.495 . . . . 10.0 111.959 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.57 -19.13 46.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.163 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -121.39 -35.81 3.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.082 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' SER . . . . . 0.613 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.9 m -119.58 143.71 35.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.106 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 41.6 Cg_endo -70.19 142.84 47.05 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.326 2.018 . . . . 10.0 111.143 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' PRO . 78.5 Cg_exo -49.82 128.4 21.48 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.182 2.588 . . . . 10.0 112.625 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -65.9 111.67 3.41 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.442 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 12.5 tp -137.42 134.91 18.82 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.509 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 100' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 23.9 Cg_exo -65.87 131.09 26.27 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.867 2.378 . . . . 10.0 112.17 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -69.67 -29.69 67.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.092 0.472 . . . . 10.0 110.577 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.439 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.6 m -71.52 -13.01 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.192 0.52 . . . . 10.0 110.76 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.478 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 83.9 mmm -116.56 17.58 15.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.781 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.604 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 79.9 tttt -85.25 -54.28 0.44 Allowed Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 112.796 0.665 . . . . 10.0 112.796 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.8 Cg_exo -74.15 73.18 3.87 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.208 1.939 . . . . 10.0 111.747 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 106' ' ' GLN . . . . . 0.478 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 29.4 mt-30 -139.61 162.39 35.21 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.25 167.75 15.36 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.874 0.368 . . . . 10.0 111.804 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 131.91 34.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.258 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.38 -154.99 23.92 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.902 -0.665 . . . . 10.0 112.552 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.32 -32.63 17.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.978 0.418 . . . . 10.0 111.149 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.538 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 36.2 m -89.11 163.73 15.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.371 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.71 129.13 38.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 68.85 15.18 8.95 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.645 0.591 . . . . 10.0 111.62 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.538 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.8 tt0 -81.58 121.64 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -103.12 132.91 49.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.828 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.72 109.0 19.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.6 t -78.61 128.36 38.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 10.0 111.68 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.766 0.317 . . . . 10.0 111.446 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -123.08 113.63 19.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.382 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 3' ' ' LEU . . . . . 0.692 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 28.2 mt -83.84 133.3 34.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.167 -0.47 . . . . 10.0 109.845 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.2 mt -117.92 108.82 25.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.2 p -83.61 166.47 18.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.061 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -14.49 60.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 10.0 111.755 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -86.29 -2.64 58.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 10.0 110.604 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.8 23.8 59.24 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.006 -0.616 . . . . 10.0 111.922 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.85 127.58 44.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -94.26 136.49 34.49 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.796 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 11' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -123.92 102.5 7.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.873 0.368 . . . . 10.0 111.207 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 12' ' ' ILE . . . . . 0.616 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 15.8 mm -87.15 115.04 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.4 t -102.82 139.24 24.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.291 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 14' ' ' LYS . . . . . 0.979 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 49.0 tttt -62.38 133.57 55.24 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 45.0 ttt180 -55.34 -35.86 65.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.869 -179.07 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 16' ' ' GLU . . . . . 0.468 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 62.2 tt0 -54.04 -44.21 70.82 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.102 0.477 . . . . 10.0 110.953 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -81.16 -43.08 19.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.622 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.11 74.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.361 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 19' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.5 mt -64.81 -41.06 96.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.86 0.362 . . . . 10.0 110.765 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 20' ' ' THR . . . . . 0.407 HG21 HG13 ' C' ' 63' ' ' VAL . 3.8 m -65.64 -48.23 72.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 12.3 m -61.01 -33.73 73.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.859 0.362 . . . . 10.0 110.873 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.09 -9.4 71.62 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.052 -0.594 . . . . 10.0 112.345 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 6.0 m -99.44 2.16 44.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.515 0.674 . . . . 10.0 110.052 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.66 160.48 5.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 25' ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 7' ' ' SER . 76.2 tttt -64.95 101.27 0.48 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 10.0 111.144 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -120.76 166.92 13.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.161 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 27' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 53.6 mmm -76.86 34.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mp -71.61 -25.19 62.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.119 0.485 . . . . 10.0 110.361 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -94.0 16.71 13.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.384 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 30' ' ' GLY . . . . . 0.452 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -83.74 -56.88 2.53 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.42 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 31' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 26.9 Cg_endo -62.03 166.98 11.39 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.602 2.202 . . . . 10.0 112.706 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.53 92.81 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.887 -0.597 . . . . 10.0 113.069 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -152.93 114.79 4.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.81 0.338 . . . . 10.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -82.31 79.74 8.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.842 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.28 163.06 28.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.273 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 36' ' ' GLU . . . . . 0.404 ' HA ' ' OG1' ' C' ' 39' ' ' THR . 33.2 mt-10 -59.67 -19.5 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -64.22 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 38' ' ' GLU . . . . . 0.504 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.0 OUTLIER -69.31 -20.33 63.88 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.547 179.611 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 39' ' ' THR . . . . . 0.404 ' OG1' ' HA ' ' C' ' 36' ' ' GLU . 2.7 m -74.53 -30.77 61.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.02 0.438 . . . . 10.0 110.647 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -94.06 -55.78 3.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.22 92.95 4.27 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 42' ' ' VAL . . . . . 0.576 ' HB ' HD23 ' C' ' 3' ' ' LEU . 1.6 t -85.82 97.01 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.172 -178.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -84.09 111.65 19.51 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.927 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 44' ' ' PHE . . . . . 0.443 ' HB3' HD12 ' C' ' 47' ' ' ILE . 3.0 m-85 -115.72 109.94 18.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -96.74 163.45 12.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.191 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 69.53 7.17 6.09 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.525 0.516 . . . . 10.0 111.72 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 47' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' C' ' 44' ' ' PHE . 60.1 mt -122.76 106.22 34.71 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.121 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 48' ' ' PRO . . . . . 0.5 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 45.9 Cg_exo -58.6 145.02 96.76 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.874 2.383 . . . . 10.0 112.024 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.7 p -58.35 -41.29 84.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.503 -179.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.95 -55.64 28.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.917 -0.583 . . . . 10.0 112.361 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.6 m -67.62 -34.41 67.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 121.077 -0.249 . . . . 10.0 111.61 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.08 -33.51 75.93 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 39.2 m -61.89 -39.75 93.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.403 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -65.68 -37.67 87.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.314 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 55.2 t -63.99 -44.88 97.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.575 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.3 m -61.18 -39.65 90.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.649 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.9 mtm -68.29 -38.04 81.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 58' ' ' TYR . . . . . 0.618 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 76.4 t80 -63.35 -44.11 95.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.76 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 59' ' ' PHE . . . . . 0.41 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.4 m-85 -63.44 -42.92 98.67 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 179.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 78.9 m -59.05 -43.75 91.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.839 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 61' ' ' TYR . . . . . 0.487 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 53.7 t80 -66.29 -43.6 85.88 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.496 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -60.87 -41.17 95.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.666 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 63' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 59' ' ' PHE . 50.5 t -57.58 -47.14 85.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 10.0 110.392 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -75.11 -40.44 59.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.707 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 65' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -58.83 -43.39 90.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.66 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.79 18.79 4.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.148 0.499 . . . . 10.0 111.111 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -123.75 -68.82 0.85 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.028 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.48 -23.29 4.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.969 0.414 . . . . 10.0 111.842 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.795 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 12.3 m -84.46 27.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.207 0.527 . . . . 10.0 111.808 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -0.32 40.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.26 0.552 . . . . 10.0 110.606 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.86 -17.21 33.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.803 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 33.4 pt -103.44 163.3 17.71 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.836 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -69.16 168.91 19.41 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.928 2.419 . . . . 10.0 112.403 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -70.05 166.87 18.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.082 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 75' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 53.1 t80 -52.12 130.01 40.56 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.859 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 76' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 38.6 Cg_exo -58.49 124.14 15.17 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.809 2.339 . . . . 10.0 112.115 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 77' ' ' ILE . . . . . 0.946 HG22 ' HA ' ' A' ' 16' ' ' LEU . 11.1 pt -78.19 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.341 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 78' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.85 -55.84 0.16 Allowed Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 79' ' ' PRO . . . . . 0.619 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 17.4 Cg_exo -68.41 103.71 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.25 1.967 . . . . 10.0 111.483 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 80' ' ' GLU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 3.7 pt-20 -74.58 58.68 0.79 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.511 0.559 . . . . 10.0 112.511 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 14.8 mm -122.2 -4.73 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.187 0.517 . . . . 10.0 110.796 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 82' ' ' ALA . . . . . 0.582 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -69.38 -34.62 74.82 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.155 -0.34 . . . . 10.0 111.582 -179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 83' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 19.3 tp -68.21 -33.2 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 84' ' ' GLU . . . . . 0.562 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 16.8 mp0 -63.01 -36.51 83.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.219 -0.9 . . . . 10.0 109.663 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 85' ' ' LEU . . . . . 0.772 ' HB3' HD21 ' A' ' 8' ' ' LEU . 76.6 mt -74.39 -34.14 63.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.425 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 86' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -68.26 -17.3 64.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.83 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.0 ttp -63.67 -18.27 63.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.793 179.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.51 75.99 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.477 -0.564 . . . . 10.0 109.477 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.71 -68.49 0.14 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.373 -0.831 . . . . 10.0 112.962 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -80.85 47.52 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.345 0.593 . . . . 10.0 111.266 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 91' ' ' PHE . . . . . 0.541 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 10.6 t80 . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 N-CA-C 111.92 -0.472 . . . . 10.0 111.92 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -62.49 1.78 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.778 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -63.24 -31.03 72.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.606 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.484 ' HA ' ' CD1' ' C' ' 86' ' ' LEU . 2.3 tt0 -54.65 -36.45 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.066 0.46 . . . . 10.0 110.972 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -93.45 -39.97 10.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.453 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 90.0 mt -63.42 -29.56 70.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.684 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.27 -40.95 98.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.795 0.331 . . . . 10.0 110.984 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.4 tp -68.04 -31.87 71.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.206 0.527 . . . . 10.0 109.83 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.12 15.71 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.448 -0.796 . . . . 10.0 110.3 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.78 -39.27 2.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.952 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.626 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.3 OUTLIER -164.94 122.6 1.61 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.906 179.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.3 mt -89.15 87.51 2.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.65 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 59.3 tttt -100.85 111.33 63.01 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.286 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.96 45.11 0.09 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.332 2.688 . . . . 10.0 111.595 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.526 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 14.4 mttm -95.27 175.77 6.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.131 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.36 152.43 27.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.1 0.476 . . . . 10.0 111.52 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.8 mm -113.51 141.82 28.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.879 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.952 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.4 OUTLIER -160.65 144.59 10.26 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.594 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 50.6 Cg_exo -38.5 136.04 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.331 2.687 . . . . 10.0 112.88 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 25.8 Cg_endo -61.11 134.53 53.23 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 123.119 2.546 . . . . 10.0 112.82 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.24 123.32 87.92 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.254 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.26 -12.72 36.15 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 123.087 2.525 . . . . 10.0 113.074 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -39.54 94.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.122 0.487 . . . . 10.0 110.124 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.545 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.2 t -126.82 -118.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' HG2' HG12 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -163.91 63.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.525 . . . . 10.0 110.476 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.456 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.5 tttm -157.36 153.28 27.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.241 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.3 pp -74.14 148.23 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.736 0.303 . . . . 10.0 110.534 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.638 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.8 m -81.45 163.87 22.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.254 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -111.72 102.22 10.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.748 0.308 . . . . 10.0 110.513 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.952 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -150.67 -82.34 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.301 -0.408 . . . . 10.0 110.613 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.36 -54.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.65 -0.691 . . . . 10.0 109.74 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tmm? . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 121.013 0.435 . . . . 10.0 110.774 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.56 146.67 30.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.813 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.427 HG11 HD13 ' B' ' 57' ' ' LEU . 84.7 t -131.59 118.78 40.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 121.121 0.486 . . . . 10.0 111.362 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.405 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.3 m-85 -108.68 113.86 27.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.94 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.726 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.0 OUTLIER -129.16 159.43 36.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.829 0.347 . . . . 10.0 111.581 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.664 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.9 mtm -127.01 109.02 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.845 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.407 ' CG2' ' HB2' ' B' ' 77' ' ' LEU . 48.5 mm -81.69 103.23 8.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 56.5 ttt180 -101.34 110.94 23.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.382 0.882 . . . . 10.0 113.382 -178.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.423 ' HB2' HD23 ' B' ' 77' ' ' LEU . 5.1 ttp85 -96.18 59.49 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.42 -1.326 . . . . 10.0 107.42 177.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 66.3 -83.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.948 -1.023 . . . . 10.0 112.112 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -93.22 -7.59 44.73 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.282 0.475 . . . . 10.0 112.282 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.47 HG23 ' HB2' ' C' ' 10' ' ' GLU . 2.0 m -120.84 108.41 13.9 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.738 0.273 . . . . 10.0 111.738 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 28.2 m -103.06 120.65 41.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 10.0 110.384 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.624 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.5 mt -108.01 118.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.735 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -77.19 118.56 19.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.726 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.8 OUTLIER -111.61 124.32 52.06 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.119 0.485 . . . . 10.0 111.221 -179.152 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.514 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.0 t70 -110.71 97.63 7.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.36 -167.82 1.62 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.829 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -126.33 164.21 21.54 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.47 -22.96 62.3 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -85.61 -5.23 59.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 13.5 m -82.24 142.71 31.91 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.1 p -90.99 165.38 13.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.779 0.323 . . . . 10.0 110.921 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.532 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 76.7 t -65.62 -34.45 70.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.215 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' B' ' 29' ' ' ARG . 62.1 t80 -61.4 -36.09 79.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -62.69 -38.38 90.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.722 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.652 HD11 HD21 ' B' ' 57' ' ' LEU . 40.4 mt -61.38 -42.99 99.6 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.013 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.88 -37.46 86.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' B' ' 25' ' ' PHE . 62.6 mtp180 -65.82 -34.92 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.041 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 95.2 mt -66.98 -46.31 85.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.04 -37.13 77.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.746 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.56 -39.98 85.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.671 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.6 -1.54 77.37 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.926 -0.654 . . . . 10.0 113.312 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 82.6 mt -114.41 -53.6 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.887 0.375 . . . . 10.0 111.398 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 60.7 mt -90.38 -6.84 54.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.591 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mptt 60.07 38.81 20.35 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.152 0.501 . . . . 10.0 111.678 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.419 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 26.6 mmt180 -116.42 133.1 23.02 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.463 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 44.6 Cg_exo -57.18 133.83 60.12 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 123.073 2.516 . . . . 10.0 112.255 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.5 -22.81 58.43 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.249 2.633 . . . . 10.0 112.614 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -61.5 -37.15 82.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.35 -1.02 57.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.784 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -85.44 135.68 33.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.921 0.391 . . . . 10.0 111.159 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 65.1 mmt-85 -128.0 116.35 19.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.004 178.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 71.7 mt -98.84 118.44 35.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.034 0.445 . . . . 10.0 111.05 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -115.55 112.44 22.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.491 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.55 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.3 tttm -112.78 132.14 55.38 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.68 30.02 19.61 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.107 0.479 . . . . 10.0 110.412 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 68.37 24.19 7.35 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.234 -0.894 . . . . 10.0 111.587 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -130.92 151.47 51.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.127 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.33 130.05 34.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.751 0.31 . . . . 10.0 111.034 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' B' ' 46' ' ' LYS . 95.0 mt -81.93 156.58 24.68 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -99.22 121.99 41.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.739 0.304 . . . . 10.0 110.527 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.532 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 8.5 m-20 -58.51 -29.31 66.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.646 -0.706 . . . . 10.0 112.399 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.57 2.53 84.76 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.002 -0.618 . . . . 10.0 112.872 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -106.94 154.27 21.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.986 0.422 . . . . 10.0 111.177 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 22.5 p -88.78 162.56 16.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.165 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.652 HD21 HD11 ' B' ' 27' ' ' LEU . 24.9 mt -56.98 -36.83 70.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.597 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -34.5 87.14 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.239 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -83.65 -14.12 52.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.049 0.452 . . . . 10.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . 0.543 ' HB3' HD22 ' B' ' 51' ' ' LEU . 58.8 m -95.34 6.46 48.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.108 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.96 33.3 37.24 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.404 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.445 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 24.9 m-85 -94.93 55.09 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.096 0.474 . . . . 10.0 110.618 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.19 148.42 48.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m -60.68 -16.77 42.63 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.77 -26.91 34.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.957 0.408 . . . . 10.0 110.341 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.87 -38.87 12.06 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -103.21 82.69 2.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.985 -1.007 . . . . 10.0 108.883 179.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.55 158.21 34.1 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.769 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.69 -15.81 30.18 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.319 2.013 . . . . 10.0 110.696 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.492 ' HB3' ' HE1' ' C' ' 75' ' ' PHE . 0.7 OUTLIER -94.29 -16.57 23.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.939 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.41 93.7 1.41 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.119 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.664 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.6 Cg_exo -72.99 149.73 47.42 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.928 2.419 . . . . 10.0 112.086 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.58 116.29 10.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.017 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.21 115.78 16.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.147 0.499 . . . . 10.0 111.777 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.09 133.46 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -81.68 130.06 9.45 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.017 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.423 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.7 tp -109.74 108.42 18.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.982 0.42 . . . . 10.0 111.197 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.74 123.64 46.05 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.652 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -101.11 118.27 36.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -76.29 121.37 22.86 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.09 0.472 . . . . 10.0 111.658 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.87 149.3 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -79.22 133.69 36.68 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.981 -0.288 . . . . 10.0 110.726 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 t70 75.31 -32.84 0.22 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.894 0.701 . . . . 10.0 112.894 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.8 m -69.53 110.9 5.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.961 0.41 . . . . 10.0 110.562 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -84.96 7.35 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.032 0.444 . . . . 10.0 111.61 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.64 -28.04 68.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.26 92.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.97 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -60.57 -30.62 69.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.541 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 44.2 m -70.08 -26.95 64.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.625 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.432 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 1.5 mt -101.11 2.11 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.832 0.348 . . . . 10.0 111.235 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.49 110.04 44.4 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.202 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' B' ' 95' ' ' SER . 32.0 Cg_exo -62.27 -16.12 49.06 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 123.055 2.503 . . . . 10.0 111.93 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -79.14 1.63 23.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.605 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 16.6 m -142.72 -45.71 0.31 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.501 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.54 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 22.3 m -108.38 133.74 20.47 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.081 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.87 153.63 47.9 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.378 2.052 . . . . 10.0 110.672 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -50.01 120.08 5.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.008 2.472 . . . . 10.0 111.915 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -60.53 121.79 13.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.603 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.1 tp -144.91 122.98 6.54 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 10.0 109.903 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.59 133.78 47.48 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.626 2.217 . . . . 10.0 111.153 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . 0.492 ' O ' ' HD3' ' B' ' 105' ' ' PRO . 17.8 t70 -61.21 -35.88 78.39 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 29' ' ' VAL . 23.0 m -69.54 -18.42 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.112 0.482 . . . . 10.0 111.041 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.603 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.7 mmm -110.2 27.91 9.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.506 0.669 . . . . 10.0 109.35 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.457 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 31.1 ttpt -103.22 -49.73 0.15 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.471 -0.786 . . . . 10.0 113.005 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.492 ' HD3' ' O ' ' B' ' 101' ' ' ASP . 5.3 Cg_exo -76.09 51.09 3.03 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.828 2.352 . . . . 10.0 112.16 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.7 mt-30 -123.47 177.3 5.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.594 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.03 -174.4 2.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.728 0.299 . . . . 10.0 111.512 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -93.76 158.31 15.73 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.9 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.6 -137.96 8.28 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.938 -0.648 . . . . 10.0 112.751 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -17.87 22.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.856 0.36 . . . . 10.0 111.532 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 74.7 m -148.86 -174.43 4.62 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.062 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.64 151.19 42.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.67 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.2 t30 73.14 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.354 0.872 . . . . 10.0 113.354 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.458 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 40.1 tt0 -74.28 133.72 42.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.044 0.449 . . . . 10.0 111.702 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -117.09 159.1 23.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.639 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.0 106.29 12.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.946 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 t -73.04 123.97 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.128 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.325 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.972 0.415 . . . . 10.0 110.868 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' C' ' 41' ' ' GLU . 42.6 tttm -114.19 106.11 13.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.606 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.519 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 64.1 mt -89.89 141.37 28.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.671 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.416 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 21.0 mt -126.98 121.55 58.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -95.78 169.69 9.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.946 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -25.19 65.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.038 -0.528 . . . . 10.0 112.424 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -82.18 6.18 17.4 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.667 0.27 . . . . 10.0 111.382 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.99 23.25 76.69 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 10.0 111.638 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -94.67 124.98 39.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.47 ' HB2' HG23 ' B' ' 12' ' ' THR . 21.0 mt-10 -96.53 137.58 35.39 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.266 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.519 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -125.69 113.87 17.91 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.257 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.624 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.1 mm -92.94 116.99 35.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.725 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -103.6 134.64 44.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.686 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.514 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 81.5 tttt -66.1 128.42 36.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.471 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 19.0 ttt-85 -54.57 -27.6 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.821 0.674 . . . . 10.0 112.821 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -57.2 -41.78 80.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.022 0.439 . . . . 10.0 110.702 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 -85.69 -32.7 21.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.206 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -60.71 -40.16 91.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.552 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 99.1 mt -57.46 -44.96 85.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.832 0.349 . . . . 10.0 111.089 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -36.12 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.664 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -66.4 -34.41 77.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.095 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.07 -22.32 75.91 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.31 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -71.47 -28.41 63.92 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.293 0.568 . . . . 10.0 110.216 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 20.9 mt -84.47 141.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -65.38 100.24 0.47 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.931 0.396 . . . . 10.0 110.7 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -101.46 178.01 4.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.491 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.586 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 21.6 mmm -78.22 26.33 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 58.5 mt -74.41 -29.93 61.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.151 0.5 . . . . 10.0 110.256 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -90.44 -0.14 57.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.026 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.93 -62.21 5.7 Favored Glycine 0 CA--C 1.52 0.378 0 CA-C-N 115.765 -0.652 . . . . 10.0 113.348 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.36 174.45 3.41 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.666 2.244 . . . . 10.0 112.52 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.98 -62.12 6.01 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.989 -0.624 . . . . 10.0 112.391 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -130.5 125.9 35.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.808 0.337 . . . . 10.0 111.212 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -109.75 75.7 0.96 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.47 165.8 9.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.332 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -53.54 -39.39 64.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.907 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.08 -39.43 92.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.886 0.374 . . . . 10.0 110.516 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.16 -26.27 65.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.637 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -79.06 -17.87 54.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.315 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -90.78 -55.69 3.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.11 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' C' ' 2' ' ' LYS . 69.8 mm-40 -110.45 96.4 6.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 t -95.1 103.1 14.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.075 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . 0.416 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 17.6 t-20 -95.33 122.16 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.085 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.642 ' HB3' HD12 ' C' ' 47' ' ' ILE . 83.7 m-85 -104.21 139.82 38.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.703 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -109.27 138.58 45.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.747 0.308 . . . . 10.0 111.297 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 68.97 8.26 6.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.387 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.642 HD12 ' HB3' ' C' ' 44' ' ' PHE . 85.1 mt -108.54 108.7 61.17 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.277 -0.419 . . . . 10.0 110.501 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.62 149.49 84.02 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.941 2.427 . . . . 10.0 112.046 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 2.6 p -60.28 -38.69 84.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.437 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -55.5 30.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.228 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 21.7 m -66.99 -34.44 69.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.238 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.57 -35.54 81.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.549 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' C' ' 57' ' ' MET . 46.5 m -61.47 -42.55 98.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.551 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -64.52 -36.74 85.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.39 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 96.1 t -64.75 -46.85 90.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.71 -41.63 97.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.994 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' C' ' 53' ' ' SER . 44.1 mtm -65.81 -39.58 91.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.511 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.469 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 73.8 t80 -65.27 -41.36 94.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.036 -0.357 . . . . 10.0 110.036 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.6 -46.99 85.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.901 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 32.8 m -58.16 -46.51 85.57 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.722 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -61.37 -46.81 88.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.63 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -61.62 -38.05 86.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.509 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 24.5 t -58.58 -44.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.093 0.473 . . . . 10.0 110.417 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.3 mmt85 -78.28 -41.38 34.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.153 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.553 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 82.7 t80 -57.29 -49.03 77.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.919 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.04 15.18 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.915 0.388 . . . . 10.0 111.437 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 6.6 t30 -119.09 -75.86 0.58 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.628 0.251 . . . . 10.0 111.078 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.66 17.48 5.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 10.0 111.635 -179.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.553 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 66.2 m -126.25 32.32 5.24 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.021 0.438 . . . . 10.0 111.246 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.88 3.48 33.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 10.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.69 -23.49 49.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.874 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.627 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 47.4 pt -94.87 164.59 19.11 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.608 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.627 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 62.5 Cg_endo -73.48 169.63 21.84 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.394 2.063 . . . . 10.0 111.706 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.62 163.73 10.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.788 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.492 ' HE1' ' HB3' ' B' ' 70' ' ' GLN . 26.7 t80 -46.95 131.7 8.82 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.969 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -57.94 113.27 1.45 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.962 2.442 . . . . 10.0 111.656 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.0 pt -78.71 45.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.742 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.662 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -84.3 -58.01 0.38 Allowed Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.662 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 5.0 Cg_exo -79.98 108.93 2.3 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.202 1.934 . . . . 10.0 111.169 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.65 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -76.93 62.01 2.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.479 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 4.3 mm -119.15 4.28 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.27 0.557 . . . . 10.0 110.611 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.556 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -77.38 -28.74 52.94 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.15 -0.344 . . . . 10.0 111.128 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.6 tp -70.38 -29.8 66.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.476 -0.564 . . . . 10.0 109.476 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 9.1 mp0 -61.99 -33.95 75.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.184 -0.916 . . . . 10.0 109.608 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.778 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -75.63 -32.62 60.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.495 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.484 ' CD1' ' HA ' ' A' ' 9' ' ' GLN . 52.0 tp -69.45 -17.57 63.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.71 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . 0.458 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 30.5 ttp -64.72 -21.74 66.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.704 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.93 -31.44 72.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.74 -56.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.312 0.856 . . . . 10.0 113.312 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -86.11 56.23 3.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.112 0.482 . . . . 10.0 111.185 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.586 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.879 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 112.213 -0.355 . . . . 10.0 112.213 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.561 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.7 OUTLIER -82.42 -53.67 5.82 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 122.483 0.313 . . . . 10.0 111.797 -179.029 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' C' ' 85' ' ' LEU . 31.7 tp -59.92 -28.64 67.77 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.959 0.409 . . . . 10.0 110.57 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -55.87 -28.97 59.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.132 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -107.11 -36.36 6.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.468 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.559 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.1 mt -60.07 -40.97 91.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.906 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.28 -34.49 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.883 0.373 . . . . 10.0 111.223 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.65 -38.36 90.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.85 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.64 -11.48 59.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.164 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -34.5 14.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.846 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.645 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.6 OUTLIER -159.01 112.31 2.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.098 0.475 . . . . 10.0 111.122 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -81.65 90.91 2.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.557 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 62.8 tttt -101.03 106.96 47.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.273 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -94.7 35.77 0.17 Allowed 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.337 2.691 . . . . 10.0 111.91 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.5 mttm -89.85 175.43 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.113 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -75.42 159.85 30.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.185 0.517 . . . . 10.0 112.022 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.6 mm -115.79 138.23 46.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.917 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.097 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 46.1 tttp -163.96 138.73 4.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -38.91 144.77 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.783 2.989 . . . . 10.0 113.678 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.702 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 37.0 Cg_endo -64.66 154.01 74.53 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.985 2.457 . . . . 10.0 112.785 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.88 126.29 56.1 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.276 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.23 -19.31 63.22 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.272 2.648 . . . . 10.0 112.703 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -35.99 82.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.754 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -130.18 -128.75 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.553 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -156.1 59.76 0.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 10.0 110.441 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.435 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 13.5 tttm -155.66 152.35 28.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.737 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.702 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -74.0 160.04 31.86 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.674 0.273 . . . . 10.0 110.927 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.788 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -102.31 162.69 12.72 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.104 -178.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.57 111.45 23.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.699 -0.228 . . . . 10.0 110.874 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.097 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.1 t70 -164.14 -77.57 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.251 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.97 -53.56 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.691 0.62 . . . . 10.0 110.167 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.817 0 CA-C-O 118.301 -0.856 . . . . 10.0 109.691 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.909 0.385 . . . . 10.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -79.39 131.62 36.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.3 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.477 HG11 HD13 ' B' ' 57' ' ' LEU . 90.9 t -118.52 112.99 40.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.184 0.516 . . . . 10.0 110.871 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.692 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 53.7 m-85 -100.2 116.49 32.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.797 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.769 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -129.53 159.62 35.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 10.0 111.763 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 15.6 mtm -125.57 105.33 8.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.811 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.52 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.6 mm -81.15 107.16 13.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -107.39 105.02 14.75 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.553 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 12.8 ttp85 -92.35 74.86 5.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.803 -1.555 . . . . 10.0 106.803 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.637 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.9 t-160 67.29 -82.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.433 -177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 81.0 mttt -111.29 -10.54 14.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.796 0.332 . . . . 10.0 111.105 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.6 m -92.06 94.95 9.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.565 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.4 m -98.17 112.92 24.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.06 0.457 . . . . 10.0 110.624 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.508 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.0 mt -107.02 119.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -78.33 119.41 21.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.769 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -112.06 118.34 35.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.3 0.571 . . . . 10.0 111.942 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.898 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -103.27 94.81 5.71 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -118.44 -168.57 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.842 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.401 ' O ' HD12 ' B' ' 57' ' ' LEU . 2.2 mmtt -127.17 165.47 19.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -63.36 -22.43 66.87 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.814 0.301 . . . . 10.0 111.814 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 2.7 m -83.1 -8.51 59.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.8 m -77.38 136.77 38.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.077 -0.342 . . . . 10.0 110.077 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 21.1 p -86.14 161.45 18.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.716 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -64.31 -36.53 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.999 0.428 . . . . 10.0 110.337 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -63.99 -30.45 71.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.486 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.69 -35.39 80.62 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.272 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.862 HD11 HD21 ' B' ' 57' ' ' LEU . 47.6 mt -60.95 -42.43 98.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.96 -36.83 82.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.309 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -66.13 -39.16 89.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.949 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -65.73 -48.25 83.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 10.0 109.872 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -63.39 -37.51 79.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.422 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.407 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.4 OUTLIER -59.84 -37.75 80.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.185 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.28 -17.99 79.58 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.938 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.42 -52.15 9.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.983 0.421 . . . . 10.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 34.6 mt -81.44 -17.6 48.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.684 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 63.16 36.47 12.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.802 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -127.87 147.59 63.6 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.76 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.78 130.25 18.77 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.912 3.075 . . . . 10.0 114.134 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 67.4 Cg_endo -76.47 -18.37 15.72 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.846 2.364 . . . . 10.0 111.766 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -65.16 -36.04 82.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.13 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -88.12 0.95 55.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.626 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.22 133.06 34.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.901 0.381 . . . . 10.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.455 ' HB3' ' CE1' ' B' ' 45' ' ' TYR . 83.6 mmt-85 -123.3 110.04 14.7 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 97.2 mt -91.96 116.2 28.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 10.0 111.534 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' B' ' 43' ' ' ARG . 74.8 m-85 -115.19 120.98 41.57 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.02 -0.536 . . . . 10.0 112.027 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.466 ' HB3' HD21 ' B' ' 51' ' ' LEU . 21.0 tttm -121.5 127.26 50.85 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.46 36.98 16.94 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 63.8 20.8 12.39 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.656 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -127.34 146.84 50.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.582 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 tp -79.84 131.67 35.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.341 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' B' ' 46' ' ' LYS . 96.6 mt -76.98 156.33 32.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.885 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -95.56 116.51 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.499 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 50.7 m-20 -59.88 -27.91 67.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.928 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.07 1.5 88.71 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.81 -0.71 . . . . 10.0 113.412 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -113.39 166.3 11.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.583 . . . . 10.0 111.892 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -95.17 171.25 8.85 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.408 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.862 HD21 HD11 ' B' ' 27' ' ' LEU . 77.2 mt -61.83 -40.99 97.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.52 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.32 -30.58 71.5 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.397 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.75 -12.35 59.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.771 0.32 . . . . 10.0 111.352 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . 0.446 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 58.3 m -100.69 8.78 43.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.76 0.314 . . . . 10.0 111.556 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.53 1.87 68.22 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.831 -0.7 . . . . 10.0 113.107 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.446 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 82.8 m-85 -79.34 106.98 11.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.813 0.339 . . . . 10.0 110.343 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 1.3 p -137.33 174.41 10.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.138 -0.69 . . . . 10.0 109.138 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.11 -3.55 7.76 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.076 0.465 . . . . 10.0 111.537 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -91.18 -42.81 10.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.165 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.49 -34.16 18.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.762 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.692 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -106.24 107.45 18.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.483 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.512 ' HB2' ' HB3' ' B' ' 71' ' ' ALA . 68.9 mtt180 -120.85 158.5 51.98 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.008 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.504 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 9.7 Cg_endo -53.75 -36.49 82.25 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.132 2.554 . . . . 10.0 113.225 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.524 ' HG3' ' CD1' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.84 13.49 24.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 10.0 111.319 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.512 ' HB3' ' HB2' ' B' ' 68' ' ' ARG . . . -150.99 75.53 8.21 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.442 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.96 136.75 16.84 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.679 2.252 . . . . 10.0 111.284 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 117.22 8.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.699 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 21.7 m -75.17 126.38 30.91 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.334 0.588 . . . . 10.0 111.63 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.52 ' HB ' HD13 ' B' ' 7' ' ' ILE . 33.2 t -122.02 128.19 75.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.164 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.28 126.33 7.36 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' B' ' 9' ' ' ARG . 44.7 tp -104.92 98.78 8.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.918 0.39 . . . . 10.0 111.121 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.38 116.02 28.57 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -95.97 116.8 29.48 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.691 0.281 . . . . 10.0 110.569 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -74.72 109.22 8.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.448 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -130.18 130.64 44.96 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -65.41 136.05 56.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.422 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 20.2 t70 73.1 -7.38 1.51 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.586 -0.734 . . . . 10.0 112.02 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 17.4 m -95.91 100.38 12.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.094 0.473 . . . . 10.0 109.965 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -72.45 -11.32 60.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.191 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.473 ' HG2' HD11 ' B' ' 90' ' ' ILE . 34.6 tt0 -55.66 -31.67 62.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.358 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.964 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.81 -25.53 59.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.842 0.353 . . . . 10.0 111.185 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -87.67 -30.98 19.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.879 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.637 HG12 ' HB2' ' B' ' 10' ' ' HIS . 54.5 mt -78.61 -33.47 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.17 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.48 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 38.0 tt0 -69.46 115.8 36.35 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-O 120.897 0.38 . . . . 10.0 111.677 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.584 ' HA ' ' O ' ' B' ' 95' ' ' SER . 16.3 Cg_exo -69.62 -5.7 16.75 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.471 2.781 . . . . 10.0 112.102 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.48 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 13.8 t80 -68.43 -37.31 80.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.156 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.7 p -108.43 -37.82 5.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.554 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 23.8 m -104.73 141.45 22.57 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.837 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.62 161.78 39.04 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 122.507 2.138 . . . . 10.0 110.719 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.73 135.19 68.28 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.722 2.281 . . . . 10.0 112.398 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -72.79 104.1 3.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 39.4 tp -134.11 121.9 15.9 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.921 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -58.29 127.66 25.63 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.635 2.223 . . . . 10.0 111.665 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.34 -32.83 71.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.362 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.99 -20.23 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.16 0.505 . . . . 10.0 111.192 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 75.3 mmm -113.72 33.16 5.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.846 -0.615 . . . . 10.0 109.638 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.576 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.1 ttpt -97.25 -54.86 0.2 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 113.092 0.775 . . . . 10.0 113.092 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 5.8 Cg_exo -74.09 77.29 2.81 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.554 2.169 . . . . 10.0 112.483 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.592 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.5 mt-30 -139.74 172.37 12.88 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.612 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.453 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 44.9 t0 -89.39 167.38 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.0 m -100.59 135.76 41.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.87 0.367 . . . . 10.0 110.311 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.27 -153.71 12.68 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.792 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.4 p -93.49 -28.71 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 10.0 111.039 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.511 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.2 m -86.04 157.04 20.17 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.616 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.17 122.76 17.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.374 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 72.64 16.7 4.7 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 123.721 0.638 . . . . 10.0 111.791 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.5 tt0 -81.88 126.92 32.47 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -105.54 138.9 40.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.462 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -114.41 106.81 14.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.15 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.592 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -74.34 123.5 29.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.155 179.554 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.236 0.354 0 CA-C-O 120.847 0.356 . . . . 10.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.677 ' HE2' HG12 ' C' ' 4' ' ' ILE . 66.8 tttt -108.43 122.29 46.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 10.0 111.004 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 59.3 mt -99.2 124.99 44.68 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.793 HD11 ' HB3' ' C' ' 41' ' ' GLU . 2.9 mt -108.11 126.52 64.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.3 p -99.46 167.42 10.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.55 -0.295 . . . . 10.0 110.459 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.2 m -66.92 -12.75 60.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 10.0 111.595 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.22 -5.44 59.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.115 0.483 . . . . 10.0 110.266 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.69 16.2 66.42 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.837 -0.697 . . . . 10.0 111.936 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . 0.404 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -87.39 133.22 33.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 10.0 110.573 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.571 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 12.5 mt-10 -100.52 120.82 40.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.761 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.478 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 91.6 m-85 -112.78 114.32 26.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.614 0.245 . . . . 10.0 110.888 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.508 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 25.9 mm -98.2 119.97 46.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 16.8 t -106.28 136.99 38.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.793 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.898 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 55.5 tttt -60.85 128.92 38.87 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.351 -0.386 . . . . 10.0 109.98 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -52.43 -32.89 41.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.394 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.552 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 40.3 tt0 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.629 . . . . 10.0 111.137 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -81.54 -31.11 32.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.154 0.502 . . . . 10.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.14 92.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.737 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 61.7 mt -59.7 -48.99 79.47 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.759 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.563 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -62.79 -42.6 99.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.985 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -62.85 -39.1 93.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.547 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.68 -13.56 82.02 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.525 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 33.1 m -75.36 -26.88 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.218 0.533 . . . . 10.0 110.283 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 18.0 mt -83.49 153.32 3.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -64.67 93.24 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.936 0.398 . . . . 10.0 110.429 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.561 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -99.58 -178.75 3.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.689 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 67.6 mmm -77.58 28.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.641 0.608 . . . . 10.0 112.641 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.85 -28.41 65.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.094 0.473 . . . . 10.0 110.434 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 m -90.39 3.75 52.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.475 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.61 -64.24 3.43 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.695 -0.684 . . . . 10.0 113.461 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.22 175.19 4.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.6 2.2 . . . . 10.0 112.362 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.24 -33.58 64.68 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.293 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -154.47 136.28 14.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.414 . . . . 10.0 110.861 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -118.45 72.48 0.87 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.43 172.71 8.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.365 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -53.17 -31.19 41.4 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.23 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -62.9 -39.67 95.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.038 0.447 . . . . 10.0 110.378 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.543 ' O ' HG22 ' C' ' 42' ' ' VAL . 0.2 OUTLIER -76.54 -29.12 56.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.608 -0.723 . . . . 10.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -73.3 -27.7 61.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.032 0.444 . . . . 10.0 110.562 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -79.14 -57.81 3.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.755 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.793 ' HB3' HD11 ' C' ' 4' ' ' ILE . 28.3 mt-10 -128.61 109.53 11.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.135 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.543 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.6 t -94.2 109.78 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.179 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 13.3 t-20 -90.33 110.85 21.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.914 0.387 . . . . 10.0 110.949 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.591 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.6 m-85 -90.14 125.45 35.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.014 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -99.14 136.6 38.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.344 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 64.33 25.15 13.42 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.686 0.617 . . . . 10.0 111.278 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' C' ' 44' ' ' PHE . 79.1 mt -124.66 103.91 31.16 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.514 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 31.7 Cg_exo -62.04 154.98 58.45 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.289 2.659 . . . . 10.0 112.346 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 13.2 p -65.02 -35.76 82.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -55.4 -57.06 13.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 10.0 112.226 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.463 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.8 m -66.71 -35.76 75.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.388 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 21.4 tp -64.5 -38.95 92.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.742 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 58.9 m -60.74 -41.54 95.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.38 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . 0.538 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 54.2 tttp -64.49 -38.33 90.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.624 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' C' ' 51' ' ' VAL . 86.8 t -66.03 -44.76 91.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.074 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.3 m -60.73 -44.33 96.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.803 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.5 mtm -66.62 -36.79 83.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.569 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.559 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.1 t80 -64.7 -41.91 95.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.041 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.428 ' O ' HG23 ' C' ' 63' ' ' VAL . 4.2 m-85 -62.19 -44.72 95.96 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.79 -0.448 . . . . 10.0 109.79 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 24.2 m -60.09 -41.41 92.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.749 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' B' ' 70' ' ' GLN . 20.7 t80 -63.45 -44.69 93.77 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.555 -0.748 . . . . 10.0 109.806 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -63.26 -40.14 96.58 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.371 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.563 HG22 ' HB ' ' C' ' 20' ' ' THR . 49.9 t -59.87 -48.28 88.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.275 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.5 mmt85 -72.67 -38.7 67.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.378 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.444 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 85.4 t80 -57.68 -53.72 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.959 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.2 43.21 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.496 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -155.39 -54.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.174 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.91 -40.12 0.95 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.033 0.444 . . . . 10.0 111.506 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 40.8 m -83.31 53.35 2.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.011 0.434 . . . . 10.0 111.455 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.38 -1.12 45.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.266 0.555 . . . . 10.0 110.342 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' C' ' 69' ' ' SER . 0.0 OUTLIER -89.55 -22.56 22.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.056 179.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.5 pt -90.94 160.98 36.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 72.9 Cg_endo -77.03 176.95 9.49 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.156 1.904 . . . . 10.0 112.819 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -67.12 170.22 7.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.975 -1.011 . . . . 10.0 109.74 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -50.24 130.91 24.52 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.475 -0.329 . . . . 10.0 111.084 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.23 125.11 17.78 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.928 2.419 . . . . 10.0 112.621 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.645 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.5 pt -80.57 52.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.799 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -109.51 -56.34 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.475 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.7 Cg_exo -68.13 106.15 1.31 Allowed 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.968 1.779 . . . . 10.0 112.046 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 37.7 mt-10 -73.46 59.35 0.6 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.105 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . 0.659 HD11 ' HA ' ' B' ' 116' ' ' ALA . 10.6 mm -120.48 -7.31 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.573 . . . . 10.0 110.639 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.573 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -67.77 -35.42 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.741 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.557 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 23.9 tp -67.82 -36.15 79.87 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 17.1 mp0 -63.5 -35.75 81.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.116 -0.947 . . . . 10.0 109.64 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.7 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.7 mt -73.56 -35.62 65.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.209 178.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.33 -23.56 67.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.725 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.6 ttp -60.47 -22.04 63.04 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.107 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.52 -34.56 77.13 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.449 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.17 -65.31 0.19 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 124.096 0.873 . . . . 10.0 113.131 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -82.46 55.67 3.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.413 0.625 . . . . 10.0 110.622 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.689 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.3 t80 . . . . . 0 C--O 1.246 0.919 0 CA-C-N 115.163 -0.926 . . . . 10.0 108.75 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.496 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.428 -0.269 . . . . 10.0 112.428 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -66.86 -63.14 1.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -179.044 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.2 tp -61.02 -27.94 68.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.329 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -52.6 -34.1 49.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.105 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -106.47 -35.0 7.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.885 0.374 . . . . 10.0 110.648 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.569 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 61.6 mt -59.34 -45.9 90.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.921 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.673 0.273 . . . . 10.0 111.03 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.5 tp -64.22 -37.51 87.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.272 0.558 . . . . 10.0 110.082 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.51 -15.02 53.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.638 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.82 -32.71 31.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.792 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -159.32 114.98 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.618 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 2.0 pt -81.01 94.18 2.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.363 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 79.2 tttt -108.8 95.26 16.37 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.657 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.505 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 1.8 Cg_endo -84.39 78.99 2.66 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.105 2.537 . . . . 10.0 110.936 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 40.1 mttm -130.05 -170.49 2.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.387 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.673 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 49.1 mm-40 -94.16 164.71 12.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.669 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.3 mm -114.56 159.23 14.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.058 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.023 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER 179.92 142.0 0.34 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.794 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 51.0 Cg_exo -40.68 135.47 2.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.243 2.629 . . . . 10.0 112.044 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.761 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 35.9 Cg_endo -63.52 137.15 58.21 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.827 2.351 . . . . 10.0 112.388 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.409 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 94.8 mt -61.01 118.33 34.62 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.069 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 25.4 Cg_endo -61.62 -22.18 73.84 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.053 2.502 . . . . 10.0 112.617 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.03 -14.55 59.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.046 -0.524 . . . . 10.0 111.2 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.407 HG13 ' HB ' ' B' ' 102' ' ' VAL . 0.2 OUTLIER -133.1 -138.63 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.282 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -154.66 49.23 0.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 10.0 110.085 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -149.55 147.93 28.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.445 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -74.28 159.38 32.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.718 0.294 . . . . 10.0 111.158 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.535 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -99.72 169.04 9.53 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.429 -179.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.673 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 34.2 tt0 -115.86 120.17 38.36 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.298 -0.26 . . . . 10.0 110.298 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.023 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -162.55 -65.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.127 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.468 ' HA ' ' OE1' ' A' ' 21' ' ' GLN . 0.0 OUTLIER 175.07 -57.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.957 -1.127 . . . . 10.0 107.957 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 114.695 -1.139 . . . . 10.0 109.191 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tmm? . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.692 0.282 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.03 134.52 45.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.373 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.43 120.19 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 121.208 0.528 . . . . 10.0 111.707 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.76 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 69.6 m-85 -109.84 114.71 28.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.199 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.78 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.7 160.95 32.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.843 0.354 . . . . 10.0 111.56 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -129.61 107.2 9.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.011 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.559 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.2 mm -81.91 102.4 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.2 ttt180 -101.18 103.41 14.45 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.408 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.3 ttp85 -88.66 71.26 8.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.622 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.3 t-80 68.02 -81.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.193 -0.912 . . . . 10.0 111.098 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -107.28 -16.32 14.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.903 0.382 . . . . 10.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 0.9 OUTLIER -95.09 97.69 10.11 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.102 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 4.3 m -97.24 115.66 28.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.886 0.374 . . . . 10.0 110.549 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.516 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 54.3 mt -106.92 118.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.105 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -77.93 120.8 23.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.78 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -114.05 121.97 45.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.091 0.472 . . . . 10.0 111.976 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.634 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.5 t70 -107.96 98.25 7.85 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.06 -1.089 . . . . 10.0 108.06 178.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.77 -167.75 1.63 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.324 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -126.22 160.61 29.81 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -60.81 -20.62 61.96 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 12.7 m -86.73 -7.91 57.86 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m -78.11 142.59 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.6 p -90.19 164.06 14.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.787 0.327 . . . . 10.0 110.794 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.4 t -63.26 -39.31 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.369 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -61.59 -32.27 72.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.22 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.96 -38.81 89.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.633 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.727 HD11 HD21 ' B' ' 57' ' ' LEU . 61.8 mt -60.68 -42.42 97.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.033 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -64.84 -35.41 81.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.967 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -66.79 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 77.7 mt -73.18 -46.3 51.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.7 t -61.52 -34.72 62.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.521 179.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.07 -37.38 71.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.864 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.22 -5.71 89.87 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.905 -0.664 . . . . 10.0 113.072 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -105.15 -49.09 9.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.985 0.421 . . . . 10.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.32 -8.54 54.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.412 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 79.0 mttt 56.92 46.48 19.5 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.377 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 1.0 OUTLIER -142.64 143.09 24.8 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.576 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 77.5 Cg_exo -51.84 133.56 45.69 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.438 2.758 . . . . 10.0 113.488 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.94 -16.08 32.63 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.033 2.489 . . . . 10.0 111.957 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.54 -29.05 70.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.434 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -96.09 3.12 53.56 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.946 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.98 132.74 35.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 111.207 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 73.0 mmt-85 -123.86 115.89 22.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.073 178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 83.4 mt -93.41 123.09 36.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.163 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -117.26 119.47 35.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.519 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.486 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.2 tttm -125.1 134.19 52.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 57.74 34.71 24.78 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.296 0.372 . . . . 10.0 110.623 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 65.97 16.14 10.35 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.682 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -123.89 159.76 28.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.825 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.1 tp -87.89 134.32 33.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' B' ' 46' ' ' LYS . 85.8 mt -80.71 152.2 28.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.14 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -92.96 118.47 31.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.143 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 16.3 m-20 -60.25 -26.96 66.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.66 3.74 85.03 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.738 -0.744 . . . . 10.0 113.118 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -108.23 164.99 11.83 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.152 0.501 . . . . 10.0 111.574 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.2 p -96.34 169.71 9.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.675 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.727 HD21 HD11 ' B' ' 27' ' ' LEU . 32.1 mt -62.37 -39.08 92.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.543 -0.298 . . . . 10.0 111.146 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.15 -39.28 94.27 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.031 -0.604 . . . . 10.0 112.594 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -75.02 -24.28 58.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 10.0 110.958 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 63.9 m -85.86 4.44 37.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.766 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.37 14.64 61.61 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.668 -0.777 . . . . 10.0 113.413 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.515 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 57.8 m-85 -87.4 67.23 9.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.968 0.413 . . . . 10.0 110.14 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -95.01 161.89 13.95 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 24.8 m -65.83 -7.63 17.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 10.0 111.56 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -74.71 -48.54 25.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.313 0.578 . . . . 10.0 109.578 178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.03 -40.5 18.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.453 -0.794 . . . . 10.0 109.971 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.76 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -95.46 100.41 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.55 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -115.39 159.42 38.37 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.707 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -58.38 -19.26 42.55 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.881 2.388 . . . . 10.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -116.41 8.25 14.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.061 179.363 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.457 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -153.14 84.51 4.41 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.597 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.561 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.7 Cg_exo -78.31 137.47 15.05 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.844 2.362 . . . . 10.0 111.33 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.12 115.97 9.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.3 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.18 123.32 21.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.441 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.559 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.6 t -122.41 135.58 62.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.49 135.14 12.95 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.684 -0.77 . . . . 10.0 111.695 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.3 tp -116.81 99.92 7.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.96 0.41 . . . . 10.0 111.552 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.87 125.28 37.4 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -106.46 125.36 50.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.699 0.285 . . . . 10.0 110.96 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -75.31 112.18 11.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.061 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.36 139.82 48.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.34 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -77.98 145.1 36.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.392 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 61.14 15.85 6.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.041 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.5 m -127.7 107.99 10.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.638 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -87.25 4.99 40.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.613 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.503 ' O ' HG13 ' B' ' 90' ' ' ILE . 32.7 tt0 -59.9 -28.71 67.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.419 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.57 68.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.02 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.3 mt -71.36 -28.0 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.895 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 19.1 m -80.99 -25.82 36.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.245 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.622 HG12 ' HB2' ' B' ' 10' ' ' HIS . 6.4 mt -91.36 -9.83 10.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.024 0.44 . . . . 10.0 110.817 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 40.4 tt0 -91.45 107.52 22.35 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.641 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 18.1 Cg_exo -68.59 -11.85 33.06 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 10.0 111.582 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -71.23 -38.22 71.98 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.211 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -100.74 -45.75 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.205 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.0 m -106.53 155.35 38.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.771 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 160.81 30.82 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.507 2.138 . . . . 10.0 111.632 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.83 139.85 70.59 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.413 2.075 . . . . 10.0 111.923 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -70.98 96.33 1.29 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.216 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.0 tp -130.46 122.84 20.07 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.95 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.6 Cg_exo -66.01 141.24 63.38 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.902 2.402 . . . . 10.0 111.896 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.79 -35.05 79.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.53 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.407 ' HB ' HG13 ' A' ' 29' ' ' VAL . 12.6 m -68.31 -23.38 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.154 0.502 . . . . 10.0 111.012 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.2 mmm -113.88 59.19 0.67 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.589 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 34.1 ttpt -138.33 -50.88 0.02 OUTLIER Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.565 -0.743 . . . . 10.0 112.269 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 12.5 Cg_exo -73.65 50.6 2.07 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.877 2.385 . . . . 10.0 112.199 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -124.02 160.01 28.6 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.851 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.91 175.5 9.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.894 0.378 . . . . 10.0 111.497 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.9 m -99.82 137.69 37.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.511 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.75 -133.44 2.33 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.432 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.57 -43.3 5.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.037 0.446 . . . . 10.0 111.285 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 15.0 m -81.57 161.23 23.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.271 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 135.59 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.58 0.13 3.55 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.668 0.605 . . . . 10.0 111.391 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.45 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 40.1 tt0 -79.39 115.83 19.26 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.936 0.398 . . . . 10.0 110.421 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -96.98 138.47 34.46 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.069 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.31 108.29 16.73 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.959 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.3 126.57 39.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.372 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.053 179.507 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.966 0.412 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 77.7 tttt -106.39 117.8 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.051 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.539 HD22 ' HE2' ' C' ' 44' ' ' PHE . 24.9 mt -98.44 123.96 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 20.6 mt -111.51 118.57 57.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -93.38 166.59 12.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.439 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -9.79 29.75 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -87.91 4.25 45.49 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.863 0.363 . . . . 10.0 110.652 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.91 23.89 73.49 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.563 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -96.98 128.23 43.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 10.0 110.659 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 13.3 mt-10 -101.08 118.39 36.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.387 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.415 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 90.7 m-85 -109.8 117.27 33.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.767 0.317 . . . . 10.0 111.048 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.516 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -100.22 113.42 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.72 136.54 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.47 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.634 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.8 tttt -59.59 128.61 37.86 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.27 -0.641 . . . . 10.0 109.27 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 25.1 ttt180 -56.38 -28.34 58.92 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -57.19 -51.97 67.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 10.0 110.196 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -73.63 -29.61 62.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.097 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -65.15 -33.48 76.11 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.073 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 68.5 mt -61.84 -47.46 84.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.231 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.58 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.1 m -66.01 -36.34 83.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.833 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 23.3 m -68.26 -17.93 64.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.441 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -86.55 -16.17 62.5 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.063 -0.815 . . . . 10.0 111.063 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.9 m -83.55 -28.55 28.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.351 0.596 . . . . 10.0 109.639 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.11 141.96 15.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -70.38 88.46 0.65 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.356 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.481 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.06 177.05 5.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.396 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.496 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 89.2 mmm -80.07 36.97 0.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.74 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 tp -68.15 -30.33 69.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.415 0.626 . . . . 10.0 109.368 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.63 15.93 10.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.286 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.91 -64.03 3.36 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.525 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.65 169.5 12.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.565 2.176 . . . . 10.0 111.926 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.96 -52.73 50.48 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.116 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -139.08 116.62 11.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.825 0.345 . . . . 10.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -84.84 93.22 8.45 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.18 165.91 23.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.986 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -59.98 -25.35 65.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.313 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.17 -37.9 88.84 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.5 mp0 -74.27 -30.54 62.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.046 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.69 -22.35 58.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.322 0.582 . . . . 10.0 109.74 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -83.63 -61.88 1.72 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.148 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 42.4 mt-10 -130.8 109.33 10.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.512 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 0.6 OUTLIER -90.7 119.98 38.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.856 -179.078 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -93.61 114.41 26.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.9 0.381 . . . . 10.0 110.689 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.631 ' HB3' HD12 ' C' ' 47' ' ' ILE . 71.7 m-85 -103.95 99.09 8.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.359 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -89.12 147.0 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.053 -0.522 . . . . 10.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 69.75 17.91 7.59 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.698 0.624 . . . . 10.0 111.21 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.631 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.3 mt -124.73 109.52 28.14 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.895 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.91 144.52 99.45 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.048 2.499 . . . . 10.0 112.02 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.4 p -62.12 -36.76 82.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.19 -55.35 32.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.811 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.487 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.7 m -66.27 -36.26 76.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.865 -0.334 . . . . 10.0 111.214 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -63.89 -36.45 83.96 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.329 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -62.37 -41.7 98.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.058 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -66.11 -37.64 86.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.171 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.487 HG23 ' O ' ' C' ' 51' ' ' VAL . 98.7 t -63.59 -44.72 98.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 61.5 m -61.25 -42.7 99.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.433 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.4 mtm -65.15 -37.78 88.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.474 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 86.2 t80 -65.15 -43.76 90.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.403 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.44 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.8 m-85 -61.48 -44.03 97.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.003 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 27.0 m -58.77 -43.31 90.37 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.943 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.417 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 32.8 t80 -65.13 -43.77 90.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.145 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -62.57 -40.4 96.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.293 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.58 HG22 ' HB ' ' C' ' 20' ' ' THR . 44.0 t -58.82 -50.89 77.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.447 . . . . 10.0 109.911 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -69.8 -38.78 76.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.353 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.586 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 44.1 t80 -57.87 -46.35 84.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 10.0 110.822 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.62 18.72 3.78 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.343 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 12.6 t30 -125.62 -49.5 1.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.868 0.366 . . . . 10.0 111.553 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.72 -31.24 0.39 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.982 0.42 . . . . 10.0 111.774 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.586 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 6.7 m -81.44 31.7 0.34 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.403 0.519 . . . . 10.0 112.403 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.45 -12.63 60.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.339 0.59 . . . . 10.0 110.215 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -77.16 -30.32 54.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.37 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.702 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.7 pt -84.25 165.0 40.98 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.702 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.0 Cg_endo -70.95 167.58 25.57 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.403 2.069 . . . . 10.0 112.872 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -66.4 165.19 14.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.209 -0.905 . . . . 10.0 109.607 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -46.16 126.41 7.3 Favored Pre-proline 0 C--O 1.233 0.223 0 O-C-N 123.56 0.538 . . . . 10.0 111.32 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -51.21 119.72 5.81 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.097 2.532 . . . . 10.0 112.598 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.792 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.8 pt -79.58 47.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.729 -0.668 . . . . 10.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -96.49 -55.87 0.2 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 11.3 Cg_exo -71.15 107.78 2.19 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.032 1.822 . . . . 10.0 111.88 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 1.8 mp0 -76.79 59.87 1.64 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.741 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.3 mm -120.78 -2.66 8.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.268 0.556 . . . . 10.0 110.462 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.472 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -67.7 -34.02 76.06 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.149 -0.344 . . . . 10.0 111.862 -179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 86' ' ' LEU . 28.4 tp -66.11 -35.56 80.82 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.279 0.561 . . . . 10.0 109.797 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.582 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 19.1 mp0 -63.17 -34.4 77.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.254 -0.885 . . . . 10.0 109.717 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 8' ' ' LEU . 82.0 mt -73.82 -31.87 63.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.925 179.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 83' ' ' LEU . 97.1 mt -67.24 -17.05 64.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.055 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.6 ttp -69.46 -13.96 62.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.18 -33.32 74.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.932 -0.396 . . . . 10.0 109.932 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.84 -67.84 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.288 0.847 . . . . 10.0 113.288 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -83.89 42.5 0.86 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 10.0 111.437 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 2.6 t80 . . . . . 0 C--O 1.246 0.873 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.692 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.448 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -57.83 -60.03 4.32 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.205 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.742 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.4 tp -62.91 -29.03 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 10.0 112.012 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.484 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 3.4 mt-30 -58.96 -33.37 70.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 10.0 111.125 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -95.93 -37.79 10.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.454 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 93.1 mt -63.69 -45.9 87.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.425 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.07 -28.25 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 10.0 111.308 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.88 -33.09 75.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 10.0 110.373 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.91 -13.03 40.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.243 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.98 -35.49 23.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.708 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HA ' HG22 ' C' ' 77' ' ' ILE . 9.8 tp -159.62 122.44 3.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.371 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 11.1 mt -89.31 88.11 2.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -99.18 102.86 17.12 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.179 0.437 . . . . 10.0 112.179 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 4.3 Cg_endo -89.48 93.1 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.162 2.575 . . . . 10.0 110.261 178.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -157.2 177.49 11.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.462 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 45.3 mm-40 -87.36 152.38 22.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.96 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.868 HD11 HD23 ' C' ' 83' ' ' LEU . 49.2 mm -118.13 107.14 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.27 -179.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.817 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 27.9 tttp -117.68 144.32 34.09 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.721 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 24.4 Cg_exo -32.3 133.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 124.265 3.31 . . . . 10.0 113.742 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.831 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.3 Cg_endo -62.2 138.15 70.4 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 123.105 2.537 . . . . 10.0 112.701 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -72.76 124.79 91.16 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.404 179.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.63 -10.36 28.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.218 2.612 . . . . 10.0 112.912 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -36.84 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.861 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 30' ' ' ARG . 3.1 t -129.24 -103.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.399 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG2' HG12 ' A' ' 29' ' ' VAL . 2.0 ptp180 -178.33 63.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.899 0.48 . . . . 10.0 111.112 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -156.09 145.03 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.831 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.5 pp -72.05 149.5 44.81 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.12 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.3 m -84.67 137.7 33.1 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -97.28 80.85 2.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.108 0.48 . . . . 10.0 110.564 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.0 t70 -125.87 -75.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.601 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.85 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.468 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.666 -0.683 . . . . 10.0 109.396 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.433 ' HA ' ' OE1' ' B' ' 20' ' ' GLU . 12.1 mmm . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.666 0.27 . . . . 10.0 111.177 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.82 131.02 3.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.144 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.454 HG11 HD13 ' B' ' 57' ' ' LEU . 47.2 t -134.93 121.8 35.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.962 0.41 . . . . 10.0 111.004 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.92 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 34.4 m-85 -111.26 121.01 44.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.719 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.733 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -135.6 160.19 39.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.811 0.339 . . . . 10.0 111.366 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.635 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 37.3 mtm -126.45 108.42 11.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.043 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.432 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.3 mm -80.44 103.6 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -98.97 102.64 14.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.554 ' HB2' HD23 ' B' ' 77' ' ' LEU . 15.8 ttp85 -90.46 69.59 6.88 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.228 -1.397 . . . . 10.0 107.228 177.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.7 t-160 68.57 -77.05 0.05 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.888 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.441 ' HD2' ' CD2' ' C' ' 9' ' ' HIS . 74.1 mmtt -112.06 -20.9 11.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.892 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -90.5 101.0 13.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.773 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 3.0 m -100.48 117.19 34.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.949 0.404 . . . . 10.0 110.812 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.577 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 56.4 mt -107.27 116.75 51.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.02 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -76.82 118.32 19.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.733 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.4 m -110.31 117.92 34.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.122 0.487 . . . . 10.0 111.529 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 1.019 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -108.73 103.73 12.88 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.131 -1.063 . . . . 10.0 108.131 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -135.05 -159.66 0.98 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.902 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -129.73 167.91 17.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 31.8 mp0 -64.81 -23.55 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.909 0.385 . . . . 10.0 110.793 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -16.76 63.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.547 -0.751 . . . . 10.0 111.798 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . 0.41 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 7.7 m -78.46 145.54 34.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.746 0.308 . . . . 10.0 110.725 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.7 p -98.39 163.81 12.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.311 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 53.8 t -60.6 -38.09 77.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 110.491 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -61.18 -31.8 71.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.515 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -72.38 -28.12 62.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.772 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.511 HD11 HD21 ' B' ' 57' ' ' LEU . 86.6 mt -65.9 -41.4 91.54 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -60.46 -36.65 78.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.95 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -63.71 -41.01 98.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.144 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -65.77 -47.04 87.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.022 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.32 -40.6 89.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.209 0.528 . . . . 10.0 110.234 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.58 -38.71 92.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.875 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.86 -15.01 66.34 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.735 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.4 mt -103.69 -50.07 9.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 10.0 111.48 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 65.9 mt -83.51 -20.94 33.01 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.635 0.605 . . . . 10.0 112.635 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt 57.77 53.49 7.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.213 0.53 . . . . 10.0 111.61 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 73.4 mtt-85 -139.9 154.51 70.72 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.636 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.48 121.72 6.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.55 2.834 . . . . 10.0 113.766 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.44 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 64.5 Cg_endo -74.28 -18.44 20.68 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.868 2.379 . . . . 10.0 112.645 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -70.49 -25.01 62.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.826 0.346 . . . . 10.0 111.846 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -95.68 3.31 54.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 80.4 mt-30 -84.06 102.53 12.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.783 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.771 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.1 mmt-85 -89.65 97.86 11.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.135 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 87.5 mt -82.11 111.29 18.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.31 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -110.25 115.62 30.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' B' ' 51' ' ' LEU . 45.9 tttm -124.39 137.22 54.48 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.231 -1.026 . . . . 10.0 108.231 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 61.71 26.4 16.06 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.253 0.346 . . . . 10.0 110.329 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 72.66 12.47 5.39 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.159 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -127.05 162.27 26.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.382 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.7 tp -82.35 133.64 35.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.587 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' B' ' 46' ' ' LYS . 74.5 mt -77.94 146.76 35.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.73 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HD2' ' B' ' 55' ' ' LYS . 34.7 t0 -94.49 122.26 36.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 10.0 111.592 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 9.1 m-20 -60.88 -26.79 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.218 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.47 11.98 59.98 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.508 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' B' ' 52' ' ' ASP . 39.8 mttp -126.12 153.86 43.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.005 0.431 . . . . 10.0 111.19 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.8 p -84.45 170.09 13.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.511 HD21 HD11 ' B' ' 27' ' ' LEU . 38.2 mt -61.08 -39.39 89.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.4 -0.363 . . . . 10.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.21 96.21 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.64 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -69.94 -19.14 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.858 0.361 . . . . 10.0 111.332 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.28 10.26 22.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.933 0.397 . . . . 10.0 111.475 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.82 51.49 5.87 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.654 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.542 ' HE1' ' HB3' ' B' ' 73' ' ' ALA . 9.1 m-85 -114.99 78.62 1.18 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.925 0.393 . . . . 10.0 110.486 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -92.21 168.09 11.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -11.41 57.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.14 0.495 . . . . 10.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -83.71 -40.63 18.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.124 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.1 -27.83 26.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.479 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.92 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -114.25 94.85 4.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 55.5 mtt180 -116.04 155.37 48.08 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.769 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.6 -13.39 35.01 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.162 1.908 . . . . 10.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.44 ' OE1' ' HD3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -104.51 -4.96 22.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.948 -1.024 . . . . 10.0 110.056 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.93 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -164.3 93.07 1.01 Allowed Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.965 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.635 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.1 Cg_exo -78.14 140.43 17.74 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.8 2.333 . . . . 10.0 110.914 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . 0.542 ' HB3' ' HE1' ' B' ' 62' ' ' PHE . . . -66.61 113.52 4.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 -179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.43 122.97 20.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.813 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.432 ' HB ' HD13 ' B' ' 7' ' ' ILE . 53.9 t -120.23 132.61 69.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 108.655 -0.868 . . . . 10.0 108.655 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.86 131.25 10.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.244 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' B' ' 9' ' ' ARG . 46.4 tp -109.26 97.05 6.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.964 0.411 . . . . 10.0 111.04 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.771 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.78 105.55 17.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.136 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -88.89 105.63 17.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.133 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -77.41 116.93 18.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.318 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -125.06 148.58 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.207 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.85 130.1 42.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.383 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t0 61.9 27.76 16.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.534 0.683 . . . . 10.0 111.382 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 13.6 m -124.16 106.05 10.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.241 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -78.52 -9.63 59.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.859 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 44.6 tt0 -56.28 -38.42 71.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.948 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.62 74.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.916 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.14 -24.57 65.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.471 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 13.9 m -84.17 -21.19 31.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.913 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.5 mt -91.91 -34.45 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.108 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 73.8 tt0 -64.24 115.49 20.04 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.58 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.512 ' HA ' ' O ' ' B' ' 95' ' ' SER . 22.6 Cg_exo -66.87 -11.06 30.61 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.037 2.491 . . . . 10.0 112.15 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -72.8 -25.86 61.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.765 -0.458 . . . . 10.0 109.765 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.63 -51.4 2.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.597 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.512 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 41.9 m -96.55 139.51 21.69 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.396 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.76 166.38 29.03 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.673 2.249 . . . . 10.0 111.181 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.45 115.19 2.3 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.729 2.286 . . . . 10.0 112.281 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -70.31 99.76 1.6 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.931 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 tp -131.83 128.28 21.56 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.336 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.555 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 71.5 Cg_exo -52.06 124.91 15.82 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.034 2.49 . . . . 10.0 112.151 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.58 -38.79 85.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.459 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 m -67.14 -19.0 24.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.188 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.555 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 66.8 mmm -115.71 41.01 2.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.467 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 35.4 tttm -111.65 -53.13 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 8.1 Cg_exo -73.96 66.5 5.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.587 2.191 . . . . 10.0 112.237 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -134.37 173.98 11.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.711 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.838 ' HB2' HE22 ' B' ' 118' ' ' GLN . 2.2 t70 -87.18 179.84 6.57 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 9.5 m -108.79 148.33 30.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.262 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . 0.43 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -87.75 -150.16 18.82 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.26 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.6 -31.59 15.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.293 0.568 . . . . 10.0 110.458 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.93 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.3 m -96.09 163.78 12.97 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.092 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.18 140.55 54.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.18 -8.14 1.04 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.623 0.577 . . . . 10.0 111.73 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.43 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 37.9 tt0 -75.56 125.89 29.93 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -110.27 156.15 21.08 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.977 0.417 . . . . 10.0 111.143 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.44 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -123.15 103.3 8.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.045 179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.25 126.79 34.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.577 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.838 HE22 ' HB2' ' B' ' 107' ' ' ASP . 15.2 mp0 . . . . . 0 C--O 1.237 0.43 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.193 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.049 0.452 . . . . 10.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 80.2 tttt -109.71 122.58 47.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.575 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 41.1 mt -99.28 132.26 44.73 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.916 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' C' ' 41' ' ' GLU . 11.2 mt -114.51 119.64 62.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.721 0.296 . . . . 10.0 110.22 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 m -85.55 156.52 20.72 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.319 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.7 m -61.82 -25.13 67.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -9.22 58.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.845 0.355 . . . . 10.0 111.263 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.83 28.87 8.02 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.686 -0.768 . . . . 10.0 112.895 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . 0.441 ' CD2' ' HD2' ' B' ' 11' ' ' LYS . 8.7 m170 -101.61 145.76 28.62 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.785 -0.244 . . . . 10.0 110.346 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.447 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 21.8 mt-10 -114.74 130.76 56.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.358 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 78.7 m-85 -122.91 118.85 28.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.496 -0.32 . . . . 10.0 110.801 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -102.04 118.58 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 25.3 t -106.84 139.89 26.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 121.229 -0.188 . . . . 10.0 110.77 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 1.019 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 70.4 tttt -60.26 128.5 37.07 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -54.3 -32.85 57.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.983 0.364 . . . . 10.0 111.983 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.498 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 42.3 tt0 -58.34 -37.98 76.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.016 0.436 . . . . 10.0 110.937 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -86.08 -40.17 16.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.178 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.35 90.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.987 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 72.7 mt -59.65 -46.2 89.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.934 0.397 . . . . 10.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -67.81 -32.35 72.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.527 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 25.7 m -69.12 -34.78 75.59 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.1 -10.5 84.18 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.657 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 7.9 m -81.13 -21.49 39.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.92 -0.771 . . . . 10.0 108.92 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -81.28 154.69 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.247 -1.02 . . . . 10.0 108.247 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -73.53 82.59 1.49 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.992 0.425 . . . . 10.0 110.732 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -91.52 170.06 10.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.955 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.692 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 82.6 mmm -78.89 45.13 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.527 0.565 . . . . 10.0 112.527 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.87 -26.47 62.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.273 0.559 . . . . 10.0 109.554 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.76 6.05 37.01 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.346 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.03 -58.44 14.52 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.432 -0.804 . . . . 10.0 113.338 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.47 -175.48 1.58 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.264 1.976 . . . . 10.0 111.899 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.62 -58.71 5.68 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.69 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -137.23 118.32 14.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.69 0.281 . . . . 10.0 110.282 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -79.79 83.18 5.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.148 0.499 . . . . 10.0 110.049 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.94 158.57 34.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.197 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.9 -27.67 60.98 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.752 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -60.37 -45.24 94.22 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.542 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.3 tp10 -74.29 -28.91 61.41 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.523 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -67.48 -26.25 66.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 10.0 110.789 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -89.98 -57.63 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.687 ' HB3' HD11 ' C' ' 4' ' ' ILE . 19.4 mt-10 -119.44 93.22 4.0 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.791 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -80.54 108.53 14.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.125 -178.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . 0.54 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 27.2 t-20 -92.57 118.25 30.81 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.761 0.315 . . . . 10.0 110.246 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.586 ' HB3' HD12 ' C' ' 47' ' ' ILE . 91.7 m-85 -95.33 138.99 32.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 10.0 111.953 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 mmt85 -105.48 135.37 47.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.123 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 62.04 27.46 16.6 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.722 0.638 . . . . 10.0 111.796 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.586 HD12 ' HB3' ' C' ' 44' ' ' PHE . 81.6 mt -124.56 107.06 29.53 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-O 121.072 0.463 . . . . 10.0 111.02 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.445 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 16.5 Cg_exo -70.84 138.38 34.26 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.204 2.603 . . . . 10.0 111.913 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . 0.437 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 0.9 OUTLIER -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.97 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -34.17 71.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.06 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.524 ' HB ' HD21 ' C' ' 85' ' ' LEU . 17.4 m -93.59 -27.89 4.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.676 -0.41 . . . . 10.0 110.586 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -67.39 -34.0 76.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.951 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.93 -40.27 92.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.052 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -65.49 -35.38 80.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.403 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.16 -42.98 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 47.1 m -62.86 -41.48 99.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.352 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 60.9 mtm -66.49 -37.14 84.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.614 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.581 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -64.02 -44.1 93.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.165 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.431 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.2 m-85 -61.88 -44.24 97.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.281 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 30.1 m -60.62 -42.54 97.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.836 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -65.19 -42.04 93.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.997 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 20.9 tptt -62.79 -42.62 99.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.523 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 59' ' ' PHE . 68.3 t -60.03 -46.21 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.605 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.4 mmt85 -72.4 -38.47 68.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.958 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.879 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 74.6 t80 -59.8 -55.34 35.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.134 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 51.94 1.83 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.989 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -170.14 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.309 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.77 -38.27 1.01 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.326 0.491 . . . . 10.0 112.326 -178.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.879 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.3 m -83.75 28.44 0.58 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.919 0.39 . . . . 10.0 111.78 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.48 -12.96 61.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.844 0.354 . . . . 10.0 111.0 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -82.74 -20.42 36.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.73 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.738 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.42 169.08 8.6 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.758 -0.201 . . . . 10.0 110.463 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.738 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 71.9 Cg_endo -77.98 173.32 14.17 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.272 1.982 . . . . 10.0 113.002 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.557 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 15.4 tp10 -70.12 177.69 3.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.692 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.557 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 5.2 t80 -53.94 127.35 53.46 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -54.4 120.26 7.73 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.76 2.307 . . . . 10.0 112.315 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.735 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.5 pt -76.16 55.93 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.396 0.617 . . . . 10.0 110.917 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.669 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.28 -56.69 0.11 Allowed Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.834 -0.621 . . . . 10.0 112.187 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.669 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.9 Cg_exo -68.19 121.01 7.97 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.691 1.594 . . . . 10.0 110.529 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -77.62 29.02 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 46.9 mm -116.71 96.71 4.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.121 -0.696 . . . . 10.0 109.121 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.14 -40.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.431 -0.804 . . . . 10.0 109.605 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.868 HD23 HD11 ' A' ' 22' ' ' ILE . 4.4 tp -67.56 -22.77 65.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.617 -0.882 . . . . 10.0 108.617 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.701 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 31.9 mp0 -64.83 -32.76 74.6 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.812 -1.085 . . . . 10.0 109.164 177.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.742 ' HB3' HD21 ' A' ' 8' ' ' LEU . 64.9 mt -80.44 -33.55 36.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.297 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.484 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.6 tt -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.104 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . 0.456 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 36.2 ttp -63.61 -16.79 61.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.28 69.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.093 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.51 -68.65 0.17 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.053 0.76 . . . . 10.0 113.053 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -82.04 45.8 0.95 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 10.0 111.342 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.244 0.809 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 179.614 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 120.719 0.066 . . . . 10.0 112.962 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -68.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.324 0.861 . . . . 10.0 113.324 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.841 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.1 tp -61.6 -29.14 69.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.351 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.54 -31.41 46.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.116 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -105.07 -42.9 5.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.383 179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.547 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 82.5 mt -57.88 -41.44 82.51 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.26 70.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.729 0.3 . . . . 10.0 111.788 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 tp -67.75 -31.01 70.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 10.0 111.379 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.3 11.02 7.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.173 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.51 -52.6 1.6 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.011 0.434 . . . . 10.0 110.572 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' C' ' 77' ' ' ILE . 5.3 mt -131.56 94.36 3.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.341 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.425 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.9 mt -73.76 100.83 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.885 0.374 . . . . 10.0 110.544 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.701 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 83.6 tttt -103.69 101.8 26.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.59 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 83.7 Cg_endo -90.3 58.75 1.57 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.988 2.458 . . . . 10.0 111.91 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.701 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 30.4 mttm -110.02 -170.53 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.54 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.813 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 35.7 mm-40 -87.51 163.45 16.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.1 mm -112.61 144.84 19.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.669 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.034 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -172.33 138.85 0.97 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.006 -0.738 . . . . 10.0 109.006 179.309 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.742 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 71.4 Cg_exo -42.74 140.13 3.0 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.198 2.598 . . . . 10.0 112.423 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.64 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 44.8 Cg_endo -67.14 134.52 34.23 Favored 'Trans proline' 0 N--CA 1.465 -0.147 0 C-N-CA 122.846 2.364 . . . . 10.0 112.229 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.597 ' H ' HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -75.97 119.24 76.32 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.367 179.182 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 18.3 Cg_endo -60.27 -15.28 33.96 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.286 2.657 . . . . 10.0 113.305 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -32.41 73.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.251 0.548 . . . . 10.0 109.638 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.843 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -128.42 -127.24 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.434 -0.803 . . . . 10.0 108.861 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -163.45 61.21 0.17 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.446 0.641 . . . . 10.0 110.223 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 12.1 tttm -157.03 150.69 24.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.086 -0.961 . . . . 10.0 108.815 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.64 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.9 pp -73.9 150.56 40.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.782 0.325 . . . . 10.0 110.751 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.5 m -88.06 169.51 11.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.824 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.813 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 17.5 tt0 -116.77 121.97 43.1 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.975 -0.379 . . . . 10.0 109.975 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.034 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.0 t70 -166.9 -75.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.252 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 170.96 -47.48 0.01 OUTLIER 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.322 -179.803 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.1 tmm? . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.866 0.365 . . . . 10.0 110.526 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.67 138.71 50.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.141 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.0 t -131.04 120.17 46.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.152 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.526 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.2 m-85 -109.48 120.71 43.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.472 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.757 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -131.69 159.33 38.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.8 0.333 . . . . 10.0 111.341 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -128.74 109.54 11.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.77 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 38.7 mm -82.05 105.19 11.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -104.87 104.58 14.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.07 0.767 . . . . 10.0 113.07 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.409 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 18.3 ttp85 -93.68 81.34 4.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.215 -1.402 . . . . 10.0 107.215 177.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.452 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.4 t-160 65.52 -85.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.353 -178.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -112.69 -13.34 13.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.137 0.494 . . . . 10.0 111.222 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.9 m -90.19 103.12 15.83 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -104.13 123.71 47.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.743 0.306 . . . . 10.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.596 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 66.1 mt -113.85 118.42 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.751 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . 0.433 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 68.2 t80 -79.54 121.54 25.36 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 178.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.757 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -114.73 122.28 45.93 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.245 0.545 . . . . 10.0 111.969 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.818 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -104.97 102.91 12.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.016 -1.105 . . . . 10.0 108.016 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.51 -166.33 1.62 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.952 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -134.9 161.25 35.76 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 6.8 mp0 -58.27 -28.99 65.45 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -10.97 60.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.1 m -85.67 147.1 26.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.388 -0.227 . . . . 10.0 110.388 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.4 p -91.67 164.14 13.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.747 0.308 . . . . 10.0 111.05 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.477 HG11 ' HB3' ' B' ' 51' ' ' LEU . 7.4 t -67.5 -32.67 58.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 10.0 110.179 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -62.09 -35.97 80.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.343 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.58 -35.41 79.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.883 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.64 HD11 HD21 ' B' ' 57' ' ' LEU . 73.7 mt -61.33 -40.82 95.64 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.051 0.453 . . . . 10.0 109.859 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -63.21 -35.36 80.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.082 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -69.46 -33.78 73.42 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.802 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' B' ' 27' ' ' LEU . 96.1 mt -67.62 -44.32 86.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 85.9 t -63.83 -36.1 75.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.32 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 30.5 tt0 -61.76 -37.28 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.815 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.36 -13.36 79.89 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.7 -0.762 . . . . 10.0 112.531 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -104.32 -56.09 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 10.0 111.73 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.72 -11.52 58.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.706 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 96.0 mttt 58.72 42.93 19.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.85 -0.614 . . . . 10.0 112.455 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' B' ' 37' ' ' ARG . 48.4 mtt-85 -129.71 141.47 41.93 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.172 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -53.67 130.97 41.57 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.145 2.563 . . . . 10.0 113.104 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.06 -13.65 34.18 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.98 2.453 . . . . 10.0 112.473 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.47 -37.33 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.413 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -96.22 9.56 40.65 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.42 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -90.08 126.49 35.8 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.775 0.321 . . . . 10.0 111.091 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 81.1 mmt-85 -119.7 113.15 20.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' B' ' 51' ' ' LEU . 94.9 mt -94.09 130.13 40.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.954 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -123.01 122.38 38.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.351 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.459 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.1 tttm -124.66 133.95 53.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.18 37.74 23.82 Favored 'General case' 0 C--O 1.234 0.27 0 O-C-N 123.458 0.474 . . . . 10.0 111.543 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 64.9 18.37 11.45 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.43 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -129.17 155.31 45.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.176 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 63.7 tp -76.09 138.51 40.84 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.924 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.477 ' HB3' HG11 ' B' ' 24' ' ' VAL . 33.9 mt -89.49 158.51 17.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.645 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' B' ' 53' ' ' ASP . 8.8 t70 -80.36 -160.85 0.32 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.465 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.467 ' H ' ' CG ' ' B' ' 52' ' ' ASP . 1.0 OUTLIER -135.05 -57.05 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.013 0.435 . . . . 10.0 110.322 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.79 -23.35 64.51 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.645 -0.707 . . . . 10.0 113.087 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -69.71 154.66 41.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.784 0.325 . . . . 10.0 110.581 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 40.9 p -86.97 166.79 14.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.238 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.64 HD21 HD11 ' B' ' 27' ' ' LEU . 36.5 mt -60.97 -40.81 94.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.833 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.81 -28.4 65.7 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.92 -0.657 . . . . 10.0 112.587 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -84.43 -11.58 55.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.803 0.335 . . . . 10.0 111.309 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 38.9 m -103.77 11.88 35.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.058 0.456 . . . . 10.0 111.915 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.04 8.11 69.43 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.337 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 63.2 m-85 -87.86 90.48 8.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.579 -0.365 . . . . 10.0 110.625 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -122.88 167.93 12.92 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.6 m -67.46 -4.43 11.32 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -89.52 -44.62 9.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.98 -33.94 26.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.248 0.547 . . . . 10.0 109.755 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.526 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -107.18 100.58 10.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.295 -0.866 . . . . 10.0 109.196 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -109.9 158.01 36.14 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.959 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.07 -18.5 63.82 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.439 2.093 . . . . 10.0 111.502 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 11.6 pt20 -107.56 4.69 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.362 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.568 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -163.62 86.97 1.24 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.782 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.572 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.4 Cg_exo -76.27 146.05 27.89 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.829 2.353 . . . . 10.0 111.332 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 117.01 15.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.109 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.3 m -72.84 126.14 29.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.168 0.509 . . . . 10.0 111.656 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.7 t -123.2 133.19 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.01 134.49 12.67 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.695 -0.764 . . . . 10.0 111.759 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.43 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 48.2 tp -110.88 101.75 10.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.888 0.375 . . . . 10.0 111.167 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.08 101.27 12.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -83.96 113.92 21.33 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.714 -0.476 . . . . 10.0 109.714 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -72.3 94.49 1.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.499 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -111.77 120.42 41.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.955 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.03 144.17 55.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.863 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.08 -5.05 2.02 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.737 0.648 . . . . 10.0 111.985 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m -111.98 104.72 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.012 0.434 . . . . 10.0 110.2 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -76.52 -7.92 56.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.87 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.46 ' O ' HG13 ' B' ' 90' ' ' ILE . 47.9 tt0 -56.97 -32.96 66.6 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.025 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.08 74.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.852 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.74 -29.68 68.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.665 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 21.3 m -78.9 -21.62 47.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.398 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.46 HG13 ' O ' ' B' ' 86' ' ' GLU . 27.1 mt -89.22 -18.61 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.25 0.548 . . . . 10.0 109.927 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.665 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 37.3 tt0 -80.68 111.93 27.31 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.203 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.632 ' HA ' ' O ' ' B' ' 95' ' ' SER . 67.9 Cg_endo -75.48 10.82 1.74 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.935 2.424 . . . . 10.0 112.111 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.665 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 45.2 t80 -91.78 -31.88 15.59 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 13.2 m -116.04 -16.36 11.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.323 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.632 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.1 m -128.28 147.26 62.89 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.249 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -73.78 156.77 48.44 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.444 2.096 . . . . 10.0 111.65 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.1 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.548 2.165 . . . . 10.0 111.706 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -59.23 114.98 2.9 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.433 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.522 HD11 HE22 ' B' ' 115' ' ' GLN . 22.3 tp -138.92 129.69 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.613 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.6 Cg_exo -60.65 130.32 32.88 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.768 2.312 . . . . 10.0 111.357 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.08 -35.46 80.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.95 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.843 ' HB ' HG13 ' A' ' 29' ' ' VAL . 22.3 m -67.97 -17.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.602 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 90.7 mmm -114.2 13.29 17.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.887 0.375 . . . . 10.0 110.746 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -82.12 -50.04 0.85 Allowed Pre-proline 0 CA--C 1.541 0.61 0 N-CA-C 113.198 0.814 . . . . 10.0 113.198 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -76.92 61.47 7.12 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.128 1.885 . . . . 10.0 112.447 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 59.2 mt-30 -130.55 150.53 51.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.536 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.709 ' HB2' HE22 ' B' ' 118' ' ' GLN . 0.2 OUTLIER -77.87 158.32 29.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.441 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 37.9 m -73.16 138.6 45.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.374 -0.375 . . . . 10.0 110.407 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.72 -118.07 2.27 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.919 -0.658 . . . . 10.0 112.467 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -114.97 -46.29 2.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.986 0.422 . . . . 10.0 111.059 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 17.5 m -70.87 165.93 22.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.234 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . 0.568 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.79 120.12 13.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.197 -0.456 . . . . 10.0 109.799 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.2 t30 68.81 31.09 4.54 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.735 0.647 . . . . 10.0 111.014 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -87.1 135.64 33.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.098 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.522 HE22 HD11 ' B' ' 99' ' ' LEU . 0.8 OUTLIER -114.85 127.24 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.036 0.446 . . . . 10.0 111.38 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -100.91 115.32 30.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.539 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.489 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 1.8 t -73.29 118.08 18.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.415 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.709 HE22 ' HB2' ' B' ' 107' ' ' ASP . 16.4 mp0 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.778 0.323 . . . . 10.0 110.929 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' C' ' 41' ' ' GLU . 32.9 ttpt -112.44 117.5 32.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.886 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.7 mt -89.21 135.57 33.5 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.433 HD11 ' HB3' ' C' ' 41' ' ' GLU . 35.9 mt -116.5 121.31 67.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 120.845 0.355 . . . . 10.0 110.64 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.85 165.85 13.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.117 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 14.4 m -64.24 -26.6 68.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.688 0.28 . . . . 10.0 111.646 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' C' ' 48' ' ' PRO . 14.2 m-20 -75.4 -3.21 32.43 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.149 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.95 10.56 66.44 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.122 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . 0.452 ' HB2' ' HB3' ' C' ' 49' ' ' SER . 0.2 OUTLIER -79.29 139.9 37.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.833 0.349 . . . . 10.0 110.561 179.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.7 mt-10 -111.79 133.78 53.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.679 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.448 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 85.8 m-85 -124.81 111.03 15.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.866 0.365 . . . . 10.0 111.687 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 11.2 mm -93.31 115.77 32.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 15.9 t -102.06 142.09 17.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.502 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.818 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 67.5 tttt -62.21 130.89 47.48 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.756 -0.461 . . . . 10.0 109.756 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 49.0 ttt180 -48.17 -42.26 29.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 112.176 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.411 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 48.5 tt0 -56.54 -49.19 75.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.965 0.412 . . . . 10.0 111.385 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -68.91 -36.17 77.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.951 0.405 . . . . 10.0 110.397 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.5 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.365 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 88.8 mt -60.6 -47.96 83.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.03 0.443 . . . . 10.0 110.832 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.566 ' HB ' HG22 ' C' ' 63' ' ' VAL . 2.2 m -62.85 -45.86 90.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.54 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 15.7 m -65.77 -24.37 66.93 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.056 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.78 -6.55 86.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.042 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 41.2 m -88.05 -28.19 21.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.287 0.565 . . . . 10.0 109.855 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -78.11 150.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.241 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.42 96.9 0.26 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.161 0.505 . . . . 10.0 110.652 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -103.67 176.21 5.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.019 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.631 ' SD ' ' HA3' ' C' ' 30' ' ' GLY . 1.1 tmm? -83.79 31.43 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.57 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.91 -29.84 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.386 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.8 p -90.57 -0.52 57.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.341 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . 0.631 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . -70.39 -56.02 8.15 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-N 115.65 -0.705 . . . . 10.0 114.576 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 25.0 Cg_endo -60.72 -13.02 24.01 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.988 2.459 . . . . 10.0 114.002 -179.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 124.85 -112.05 1.67 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.766 -0.73 . . . . 10.0 111.961 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -100.22 109.88 22.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.94 0.4 . . . . 10.0 110.038 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -86.55 103.84 15.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.818 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.37 167.29 9.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.408 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -52.77 -27.16 16.68 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -57.93 -33.75 69.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.04 0.448 . . . . 10.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -97.77 -24.92 15.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.264 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -64.69 -33.78 76.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.56 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -70.32 -52.54 22.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.176 0.512 . . . . 10.0 109.93 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' C' ' 2' ' ' LYS . 52.3 mt-10 -133.9 100.57 4.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.406 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 t -80.38 108.22 13.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.19 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -89.44 124.05 34.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.15 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.595 ' HB3' HD12 ' C' ' 47' ' ' ILE . 82.6 m-85 -104.77 128.62 52.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.688 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' C' ' 45' ' ' ARG . 8.1 mmt180 -101.48 140.69 35.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.006 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 60.11 31.45 20.57 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.304 0.573 . . . . 10.0 111.545 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.595 HD12 ' HB3' ' C' ' 44' ' ' PHE . 92.2 mt -131.21 110.79 15.36 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.499 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.535 ' HA ' ' OD2' ' C' ' 7' ' ' ASP . 17.8 Cg_exo -68.88 149.49 72.47 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 123.08 2.52 . . . . 10.0 111.925 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 1.8 p -65.6 -31.71 72.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.749 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -56.27 -54.4 45.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.631 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.58 -33.61 57.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.767 0.318 . . . . 10.0 111.112 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -64.81 -32.97 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.884 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 56.2 m -59.98 -40.63 89.81 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.806 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -68.01 -35.1 77.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.382 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 44.6 t -66.41 -43.8 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.046 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.418 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 69.9 mtm -67.04 -36.45 82.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.229 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.547 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 83.6 t80 -63.83 -42.61 97.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 7.1 m-85 -60.79 -46.21 91.37 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.622 178.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -58.13 -43.31 87.19 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.451 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 26.5 t80 -66.41 -45.53 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.473 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 tptt -62.5 -40.89 98.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.419 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.566 HG22 ' HB ' ' C' ' 20' ' ' THR . 41.5 t -58.45 -44.75 89.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.161 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 64' ' ' ARG . 12.2 mmt85 -74.37 -43.74 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.597 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.523 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 47.1 t80 -54.45 -43.47 71.65 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.905 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.93 14.71 13.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.082 0.468 . . . . 10.0 111.808 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -123.44 -62.28 1.33 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.94 0.348 . . . . 10.0 111.94 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 4.7 m -148.83 38.58 0.83 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.092 0.472 . . . . 10.0 110.711 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.523 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 19.7 m -147.75 36.0 0.86 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.17 0.51 . . . . 10.0 110.57 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.07 0.93 55.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.435 0.636 . . . . 10.0 110.108 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -75.91 -29.58 58.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.609 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 pt -94.9 159.53 33.0 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.681 -0.691 . . . . 10.0 109.247 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.81 -175.6 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.452 2.101 . . . . 10.0 112.509 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 12.0 tp10 -68.76 175.91 3.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.248 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.445 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 32.5 t80 -52.4 130.59 43.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.508 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.31 116.34 2.77 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.099 2.532 . . . . 10.0 111.813 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.78 ' HA ' HD23 ' A' ' 16' ' ' LEU . 10.2 mt -78.06 72.2 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.395 0.617 . . . . 10.0 111.272 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -120.4 -59.65 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.287 -0.869 . . . . 10.0 111.419 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.569 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 72.3 Cg_endo -77.71 102.78 1.63 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.597 1.531 . . . . 10.0 111.28 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.51 69.89 2.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.968 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -119.15 10.62 6.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.426 0.631 . . . . 10.0 110.08 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.702 ' HB2' ' HB2' ' A' ' 16' ' ' LEU . . . -73.35 -35.51 65.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.15 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.545 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 19.7 tp -66.0 -34.96 79.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.416 ' HA ' HD23 ' A' ' 32' ' ' LEU . 19.5 mp0 -64.13 -33.7 76.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.592 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.841 ' HB3' HD21 ' A' ' 8' ' ' LEU . 90.1 mt -77.2 -34.15 56.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.715 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.2 -12.13 61.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.768 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 47.7 ttp -62.71 -17.42 60.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 10.0 111.465 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.7 -9.75 58.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.781 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.91 -80.62 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 O-C-N 123.826 0.704 . . . . 10.0 112.421 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -101.8 83.7 2.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.522 0.677 . . . . 10.0 111.84 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.317 -0.843 0 N-CA-C 107.626 -1.25 . . . . 10.0 107.626 178.558 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.455 ' HA2' ' OE1' ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 112.779 -0.128 . . . . 10.0 112.779 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -67.78 -59.66 3.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.769 0.285 . . . . 10.0 111.414 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 15.5 tp -63.85 -24.05 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.053 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.455 ' OE1' ' HA2' ' A' ' 6' ' ' GLY . 60.4 mt-30 -54.81 -46.31 74.51 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.007 0.432 . . . . 10.0 110.399 178.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -88.97 -33.66 17.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.504 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 63.7 mt -59.66 -42.54 93.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.76 -40.52 79.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.899 0.38 . . . . 10.0 110.626 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.4 tp -66.72 -32.29 73.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.268 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.75 -3.43 56.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.607 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.3 -34.01 9.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.068 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.656 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.8 OUTLIER -161.75 118.19 2.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.015 179.667 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 4.4 mp -81.8 94.13 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 178.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 22.1 tttt -102.04 104.72 38.03 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 18.5 Cg_endo -93.81 68.95 0.41 Allowed 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.336 2.691 . . . . 10.0 110.214 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -120.93 -175.66 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.129 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -90.62 155.43 18.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.512 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.7 mm -118.3 126.95 75.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.058 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -145.66 141.45 16.86 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.508 -0.923 . . . . 10.0 108.508 179.339 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.436 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 29.5 Cg_exo -34.07 129.04 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.879 3.053 . . . . 10.0 113.143 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.744 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.3 Cg_endo -57.01 134.62 65.74 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.21 2.607 . . . . 10.0 112.566 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.482 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -73.64 125.96 90.11 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.034 179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -68.91 -12.22 33.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.95 2.433 . . . . 10.0 112.179 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -36.84 84.83 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.849 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -126.58 -114.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.13 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.432 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.4 ptp180 -168.44 53.64 0.05 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.085 0.469 . . . . 10.0 110.958 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.7 tttm -151.17 152.01 32.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.622 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.744 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -73.96 150.94 40.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.719 0.295 . . . . 10.0 110.708 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.602 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.2 m -92.9 169.58 10.34 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.343 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.402 ' H ' HG22 ' A' ' 33' ' ' THR . 19.0 mt-10 -120.12 123.4 43.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 10.0 110.408 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.981 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.5 OUTLIER -163.84 -70.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.666 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.0 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.545 -0.909 . . . . 10.0 108.545 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.125 -0.943 . . . . 10.0 109.09 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.777 0.322 . . . . 10.0 111.259 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -107.98 133.91 51.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 10.0 111.776 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 86.8 t -122.48 116.47 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.422 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 47.1 m-85 -102.82 118.27 36.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.545 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.715 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -129.31 158.47 39.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.919 0.39 . . . . 10.0 111.501 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 2.0 mtm -127.49 108.08 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.5 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.568 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -81.07 113.43 20.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -109.97 107.03 16.79 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.721 0.637 . . . . 10.0 112.721 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.573 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 25.7 ttp85 -96.97 74.29 2.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 177.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.64 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.7 t-160 68.31 -82.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.267 -177.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -115.61 -9.37 12.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.963 0.411 . . . . 10.0 110.928 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 7.2 m -93.15 98.66 11.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.82 128.73 44.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.694 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.602 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 69.3 mt -123.42 118.54 54.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.79 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -79.05 124.03 27.89 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.715 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -117.72 125.19 50.2 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.144 0.497 . . . . 10.0 111.707 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.419 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.2 t70 -108.73 99.68 9.01 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.01 -164.26 1.1 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.495 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm -130.22 165.36 22.56 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.422 ' O ' ' HB ' ' B' ' 56' ' ' THR . 25.0 mp0 -62.54 -29.53 70.63 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 57.7 m -78.43 -7.62 57.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 15.3 m -76.85 130.27 37.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 36.6 p -82.9 162.34 21.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.72 0.295 . . . . 10.0 110.769 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.824 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 78.1 t -63.94 -32.39 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.91 0.386 . . . . 10.0 110.451 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.38 -32.84 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.209 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.56 -33.51 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.435 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.731 HD11 HD21 ' B' ' 57' ' ' LEU . 91.9 mt -61.63 -46.0 91.68 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -61.82 -35.5 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.453 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.3 mtp180 -63.24 -38.21 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 10.0 109.998 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.1 -45.21 80.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.791 -0.641 . . . . 10.0 110.065 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.86 -38.57 82.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.419 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.834 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 3.8 tm-20 -58.93 -37.89 77.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.538 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.51 1.13 83.46 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.966 -0.561 . . . . 10.0 113.028 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 98.9 mt -113.52 -55.13 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.859 0.361 . . . . 10.0 110.772 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.09 -12.32 57.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.543 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt 58.48 49.98 9.92 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.91 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' B' ' 37' ' ' ARG . 57.1 mtt-85 -138.94 143.67 38.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.166 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.31 124.26 11.54 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.355 2.703 . . . . 10.0 113.069 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.834 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.2 Cg_endo -72.52 -16.52 27.21 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.804 2.336 . . . . 10.0 111.156 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.42 -29.11 69.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.011 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -98.29 5.49 48.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.893 0.378 . . . . 10.0 111.437 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -88.37 133.21 34.15 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.519 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.413 ' HD3' HH11 ' B' ' 43' ' ' ARG . 49.3 mmt-85 -119.65 114.88 22.87 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.53 120.88 37.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.618 -0.265 . . . . 10.0 110.382 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 83.6 m-85 -117.29 130.41 56.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.509 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 43.5 tttm -135.06 133.97 39.88 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 62.83 29.73 16.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.397 0.436 . . . . 10.0 110.57 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 72.23 6.17 5.47 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.309 -0.859 . . . . 10.0 111.852 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -120.77 161.77 20.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.1 tp -77.85 145.04 36.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.844 0.354 . . . . 10.0 111.319 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 34.9 mt -87.69 151.43 22.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.932 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -97.07 108.51 21.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.124 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.824 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.5 m-20 -51.06 -44.34 61.14 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 113.337 0.865 . . . . 10.0 113.337 -178.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -70.58 -7.16 60.56 Favored Glycine 0 CA--C 1.518 0.245 0 CA-C-N 116.13 -0.486 . . . . 10.0 114.226 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -102.6 162.18 13.13 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 117.107 0.453 . . . . 10.0 111.106 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 38.2 p -90.73 167.23 12.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.081 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.731 HD21 HD11 ' B' ' 27' ' ' LEU . 33.7 mt -59.93 -40.95 90.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.621 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.54 -37.23 88.21 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.055 -0.593 . . . . 10.0 112.201 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.96 -9.85 59.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.647 0.26 . . . . 10.0 111.512 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.6 m -102.71 8.66 39.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.987 0.422 . . . . 10.0 111.036 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.95 65.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.29 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.509 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 31.2 m-85 -87.08 76.79 9.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.94 0.4 . . . . 10.0 110.334 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.23 155.56 17.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.165 -0.471 . . . . 10.0 109.762 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 5.1 m -66.08 -11.97 52.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 10.0 111.376 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -75.76 -28.36 58.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.018 0.437 . . . . 10.0 110.465 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.25 -48.49 4.37 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -89.08 82.02 6.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.204 -0.907 . . . . 10.0 109.307 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.425 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 53.8 mtt180 -94.4 158.88 34.97 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.963 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 21.5 Cg_endo -62.95 -16.08 51.8 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.537 2.158 . . . . 10.0 111.925 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -105.69 2.92 28.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.411 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.83 82.98 2.01 Favored Pre-proline 0 C--O 1.233 0.235 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.878 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.41 132.57 25.93 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.712 2.275 . . . . 10.0 111.473 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.54 119.53 8.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.784 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.93 124.45 26.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.928 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.568 ' HB ' HD13 ' B' ' 7' ' ' ILE . 25.5 t -123.0 130.89 74.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.53 131.19 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.709 -0.758 . . . . 10.0 111.924 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.4 tp -113.9 110.75 20.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.422 . . . . 10.0 111.363 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -106.79 124.38 49.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.683 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -105.41 114.08 28.04 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 -71.64 113.53 8.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.031 0.443 . . . . 10.0 111.243 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.563 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -127.73 130.1 48.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.563 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -59.95 134.9 57.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.409 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.7 t70 71.27 -10.44 0.79 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.336 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.563 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 5.0 m -100.03 100.39 11.26 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.167 0.508 . . . . 10.0 110.276 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -77.21 1.13 19.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.7 -0.682 . . . . 10.0 112.28 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.29 -33.01 68.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.943 0.401 . . . . 10.0 110.27 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.14 82.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.238 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 91.0 mt -75.32 -7.09 53.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.567 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 18.6 m -96.85 -27.88 14.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.061 0.458 . . . . 10.0 110.344 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.2 mt -88.07 -31.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.481 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.417 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 39.1 tt0 -64.27 114.65 14.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.573 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.606 ' HA ' ' O ' ' B' ' 95' ' ' SER . 31.3 Cg_exo -63.3 -22.37 72.1 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.091 2.527 . . . . 10.0 111.827 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -67.95 -26.75 66.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.267 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -106.57 -40.0 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.881 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.606 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 74.1 m -128.82 136.16 28.72 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.539 0.209 . . . . 10.0 110.941 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.43 155.38 62.7 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.709 2.273 . . . . 10.0 111.812 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.19 133.32 41.43 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.107 2.538 . . . . 10.0 112.591 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.57 104.45 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.856 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 33.4 tp -131.19 124.21 20.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.221 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.8 Cg_exo -61.55 138.08 73.39 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.812 2.341 . . . . 10.0 111.923 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.11 -38.74 87.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.003 0.43 . . . . 10.0 111.309 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 29' ' ' VAL . 8.8 m -65.25 -18.23 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.241 0.543 . . . . 10.0 111.049 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.544 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 92.7 mmm -113.81 44.34 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.699 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 70.1 tttt -120.29 -51.26 0.04 OUTLIER Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.631 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.699 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 71.6 Cg_endo -75.42 55.26 4.11 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.223 1.949 . . . . 10.0 112.48 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.544 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.0 mt-30 -127.25 148.78 50.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.244 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -74.77 160.11 31.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 17.8 m -90.31 136.49 33.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.478 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.98 -135.05 2.34 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.187 -0.53 . . . . 10.0 113.262 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.62 -53.08 4.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.861 0.363 . . . . 10.0 111.376 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.884 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 23.7 m -70.64 159.81 33.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.398 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.42 127.12 30.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.989 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 t30 71.95 17.79 5.15 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.806 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.801 ' HG3' ' HB2' ' B' ' 111' ' ' SER . 0.5 OUTLIER -76.41 120.12 21.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -100.32 124.28 45.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.072 0.463 . . . . 10.0 111.258 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.59 97.1 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.47 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -60.86 128.29 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.303 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.974 179.88 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.234 0.244 0 CA-C-O 120.902 0.382 . . . . 10.0 110.828 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.797 ' HB3' ' HG2' ' C' ' 41' ' ' GLU . 5.3 ttpp -105.29 107.57 18.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.742 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 43.7 mt -91.33 113.64 25.96 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 5.5 mt -102.89 122.91 55.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.601 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.0 p -94.38 167.66 11.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -9.37 29.18 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.099 0.407 . . . . 10.0 112.099 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -86.61 -4.83 59.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.134 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.99 17.57 69.55 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.253 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.45 126.17 39.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 33.3 mt-10 -94.95 134.31 37.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.717 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 99.2 m-85 -123.4 104.89 9.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.77 0.319 . . . . 10.0 111.106 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.627 HD11 ' HD3' ' C' ' 2' ' ' LYS . 24.4 mm -88.69 115.75 29.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.403 -0.591 . . . . 10.0 109.403 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 41.8 t -105.86 127.78 60.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.622 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.419 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 77.9 tttt -54.99 129.4 37.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.29 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.476 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 32.4 ttt-85 -57.45 -30.86 65.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 10.0 112.038 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.16 -43.15 73.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.052 0.453 . . . . 10.0 110.644 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -81.33 -41.74 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.614 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . 0.476 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -56.26 -33.78 65.79 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.733 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 50.9 mt -59.35 -44.93 92.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.85 0.357 . . . . 10.0 110.379 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.571 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.2 m -65.25 -46.42 80.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.417 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -37.43 86.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.924 0.392 . . . . 10.0 110.524 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.47 -17.77 74.82 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 116.064 -0.516 . . . . 10.0 112.09 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -80.65 -25.93 37.99 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 41.3 mt -79.41 154.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.413 -0.812 . . . . 10.0 108.931 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -71.8 87.64 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.006 0.432 . . . . 10.0 111.319 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.49 179.69 5.45 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.316 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.29 36.02 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.986 0.422 . . . . 10.0 111.48 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 9.9 tp -66.98 -31.71 72.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.326 0.584 . . . . 10.0 109.845 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 9.72 24.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.348 -0.842 . . . . 10.0 110.589 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.61 -64.47 3.69 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.877 -0.602 . . . . 10.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.61 177.11 7.22 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.694 2.262 . . . . 10.0 111.477 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.19 -77.6 0.27 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.969 -0.634 . . . . 10.0 112.215 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -117.21 116.88 28.14 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 10.0 110.521 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -95.3 89.87 5.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.82 164.43 26.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.198 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.8 -26.52 58.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.023 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -59.11 -52.76 64.34 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.463 ' O ' HG22 ' C' ' 42' ' ' VAL . 4.7 mp0 -72.63 -20.28 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.319 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 7.1 m -71.76 -29.6 64.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 10.0 110.69 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -93.03 -33.46 14.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.732 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.797 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 30.8 mt-10 -135.5 98.81 4.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.04 0.447 . . . . 10.0 110.301 179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.463 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.1 t -90.38 132.4 35.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.314 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -106.44 115.15 29.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.478 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.514 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.2 m-85 -104.1 112.88 26.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.511 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -102.86 148.19 25.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.15 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 70.13 14.59 7.69 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.687 0.617 . . . . 10.0 110.725 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.514 HD12 ' HB3' ' C' ' 44' ' ' PHE . 69.5 mt -125.19 108.27 27.41 Favored Pre-proline 0 N--CA 1.455 -0.203 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.38 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 32.0 Cg_exo -61.24 150.75 83.19 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.122 2.548 . . . . 10.0 112.384 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.2 p -61.46 -39.81 92.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . 0.413 ' CE1' ' HG3' ' B' ' 103' ' ' MET . 59.6 m80 -52.86 -56.52 15.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 10.0 112.66 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.478 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.4 m -65.2 -35.9 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.929 -0.308 . . . . 10.0 111.255 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -66.0 -35.21 79.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -61.19 -43.32 99.07 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.37 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -65.92 -35.85 81.77 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.218 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -64.12 -46.51 93.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.539 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.8 -42.52 99.11 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.624 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.53 -37.8 83.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.664 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.8 t80 -63.73 -44.03 94.76 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.995 -0.372 . . . . 10.0 109.995 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.6 m-85 -62.9 -44.21 96.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.087 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 58.6 m -57.83 -45.02 86.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.321 0.581 . . . . 10.0 109.783 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -65.56 -44.84 85.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.072 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -60.49 -40.64 92.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.296 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.571 HG22 ' HB ' ' C' ' 20' ' ' THR . 38.2 t -58.0 -48.48 84.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.458 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -74.01 -39.01 63.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.242 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.488 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 63.0 t80 -58.01 -45.57 86.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.416 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.41 23.95 2.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.131 0.491 . . . . 10.0 110.667 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -128.86 -62.41 1.01 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.57 -25.52 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.488 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.4 m -83.61 34.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.275 0.472 . . . . 10.0 112.275 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -6.5 59.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.567 0.698 . . . . 10.0 109.658 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -65.87 -26.48 67.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.738 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.632 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 23.0 pt -102.77 164.72 15.02 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.639 . . . . 10.0 109.437 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 74.0 Cg_endo -74.8 -170.85 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.458 2.105 . . . . 10.0 112.717 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -72.09 165.88 23.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.655 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -48.66 128.15 13.77 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 123.463 0.477 . . . . 10.0 111.011 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -50.14 121.89 8.34 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 123.104 2.536 . . . . 10.0 112.586 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.656 HG22 ' HA ' ' A' ' 16' ' ' LEU . 19.7 pt -79.04 52.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.669 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.518 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -99.34 -56.47 0.16 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.182 -0.463 . . . . 10.0 112.214 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.518 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 57.6 Cg_endo -70.21 117.4 5.09 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.616 1.544 . . . . 10.0 111.022 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 5.6 pt-20 -73.67 -2.61 23.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 39.7 mm -81.62 72.73 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.594 0.711 . . . . 10.0 110.604 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -137.89 -38.23 0.58 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.218 -0.901 . . . . 10.0 109.424 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.404 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.0 tp -67.97 -24.73 65.19 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.945 -0.761 . . . . 10.0 108.945 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.507 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 23.8 mp0 -62.98 -31.76 72.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.699 178.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.663 ' HB3' HD21 ' A' ' 8' ' ' LEU . 54.6 mt -77.66 -32.4 53.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.649 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -22.09 63.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.386 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.1 ttp -66.6 -19.71 65.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.332 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.68 -34.28 77.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.986 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.39 -56.97 0.5 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.959 0.787 . . . . 10.0 112.54 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -82.49 41.31 0.7 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.144 0.497 . . . . 10.0 110.592 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.241 0.647 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.525 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 112.475 -0.25 . . . . 10.0 112.475 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -68.97 -65.22 0.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.12 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.649 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.2 tp -61.31 -30.96 70.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.022 -178.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -54.73 -29.7 54.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.944 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -105.09 -37.32 6.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.587 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.596 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 80.6 mt -64.06 -44.6 91.96 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.12 -30.32 66.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 10.0 111.298 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.8 tp -66.27 -35.69 81.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.163 0.506 . . . . 10.0 110.254 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.28 -2.43 52.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.002 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -100.99 -23.2 14.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.546 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 12.3 tp -169.46 109.77 0.44 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.099 -0.5 . . . . 10.0 111.075 179.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.8 mt -82.92 83.69 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.566 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 21.5 tttt -92.35 111.37 50.15 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.394 -179.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -91.97 38.82 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.12 2.547 . . . . 10.0 112.554 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 45.5 mttm -93.48 166.13 12.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.772 0.32 . . . . 10.0 110.844 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -82.93 156.54 23.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -106.67 143.7 17.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.287 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.021 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -157.31 140.77 11.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.537 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 27.7 Cg_exo -36.08 131.52 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.802 3.001 . . . . 10.0 113.052 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.642 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.7 Cg_endo -57.18 144.05 91.56 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.432 2.755 . . . . 10.0 113.25 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mt -75.41 122.02 86.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.896 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.81 -23.28 75.89 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 123.037 2.492 . . . . 10.0 112.897 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -31.18 72.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.151 0.5 . . . . 10.0 110.47 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.484 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 m -128.46 -139.33 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.227 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.484 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 1.1 ptp180 -149.89 60.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.329 0.585 . . . . 10.0 110.352 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.4 tttm -154.64 150.55 27.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.894 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -72.98 152.65 41.27 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.837 0.351 . . . . 10.0 111.453 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.68 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.9 m -90.32 168.37 11.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.837 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 33' ' ' THR . 11.0 tt0 -114.49 107.75 15.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.782 0.325 . . . . 10.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.021 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.6 t70 -157.94 -82.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.337 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 178.6 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 O-C-N 123.482 0.489 . . . . 10.0 110.614 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.294 -0.86 . . . . 10.0 110.689 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.3 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.935 0.398 . . . . 10.0 110.512 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -77.7 135.55 38.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.406 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 94.4 t -120.67 118.84 57.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.991 0.424 . . . . 10.0 110.563 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.613 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 59.2 m-85 -106.19 112.01 24.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.057 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -127.37 158.8 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.82 0.343 . . . . 10.0 111.179 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.579 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.9 mtm -127.0 107.28 9.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.636 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.445 ' HB ' ' HB ' ' B' ' 14' ' ' ILE . 48.6 mm -78.43 106.33 8.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -101.75 101.52 12.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.259 0.552 . . . . 10.0 112.487 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.742 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.6 ttp85 -91.72 72.56 5.81 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.377 -1.342 . . . . 10.0 107.377 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.658 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.7 t-160 67.6 -80.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.075 -177.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 58.1 mttt -116.02 -5.46 11.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.97 0.414 . . . . 10.0 111.132 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.742 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 3.0 m -96.58 94.6 7.44 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 2.9 m -95.86 112.31 24.07 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.939 0.4 . . . . 10.0 110.851 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.8 mt -106.37 116.8 50.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.988 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -77.15 116.83 18.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.72 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -112.1 112.29 23.8 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.335 0.588 . . . . 10.0 111.854 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.895 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.3 t70 -100.76 103.48 14.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.432 -1.321 . . . . 10.0 107.432 178.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.13 -164.39 1.28 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.314 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -125.4 153.55 43.24 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.23 -27.35 61.95 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.169 0.433 . . . . 10.0 112.169 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -8.6 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 16.4 m -84.4 147.61 27.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.622 0.249 . . . . 10.0 110.704 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 8.2 p -92.42 163.47 13.84 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.313 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 83.5 t -64.0 -36.71 77.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.591 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.17 -32.51 71.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' B' ' 29' ' ' ARG . 39.1 mt-10 -67.3 -31.59 71.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.066 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.494 HD11 HD21 ' B' ' 57' ' ' LEU . 85.1 mt -62.26 -42.38 99.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.705 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 94.9 mttt -62.95 -37.35 86.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.061 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' B' ' 26' ' ' GLU . 81.6 mtp180 -61.84 -43.22 99.29 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.968 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.09 -48.93 81.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.093 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.6 t -61.14 -36.45 72.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.758 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.494 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.1 tt0 -60.66 -35.02 75.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.148 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.72 -18.52 72.81 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.574 -0.822 . . . . 10.0 112.276 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.3 mt -92.21 -53.46 8.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.749 0.309 . . . . 10.0 111.226 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.4 mt -84.08 -13.28 53.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 mttt 63.01 32.58 15.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.675 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -121.0 138.83 28.3 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.24 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.5 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 77.3 Cg_exo -50.33 135.08 39.07 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.314 2.676 . . . . 10.0 112.895 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.705 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 7.1 Cg_exo -74.02 -16.1 23.04 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.037 2.491 . . . . 10.0 112.521 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.78 -35.99 79.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.027 -0.533 . . . . 10.0 112.028 -178.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -101.49 16.99 23.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -92.29 124.42 36.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.1 mmt-85 -112.24 114.05 26.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.438 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -98.21 113.35 25.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.333 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . 0.464 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 94.2 m-85 -112.21 122.59 48.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.696 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.555 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 30.5 tttm -124.99 130.29 52.06 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.17 35.83 18.31 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.472 0.482 . . . . 10.0 110.488 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 68.94 12.43 8.62 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.212 -0.904 . . . . 10.0 112.908 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . 0.52 HE22 ' HE1' ' B' ' 93' ' ' PHE . 29.5 mm-40 -129.12 157.29 42.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.884 0.373 . . . . 10.0 111.496 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.35 143.35 33.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.405 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 46' ' ' LYS . 93.6 mt -93.05 156.68 16.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.243 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.434 ' OD2' ' HG3' ' B' ' 55' ' ' LYS . 15.2 t0 -92.98 119.88 32.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.788 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -57.57 -31.89 66.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.056 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.01 -3.74 90.64 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.611 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.434 ' HG3' ' OD2' ' B' ' 52' ' ' ASP . 41.3 mttp -101.1 153.72 19.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.47 . . . . 10.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.8 p -88.4 167.97 13.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.197 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.494 HD21 HD11 ' B' ' 27' ' ' LEU . 67.8 mt -60.49 -42.83 97.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 10.0 110.74 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.44 -41.52 98.62 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.622 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.24 -29.29 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.312 . . . . 10.0 111.686 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.7 m -79.85 -5.73 56.03 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.93 10.03 41.11 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.584 -0.817 . . . . 10.0 113.312 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 52.7 m-85 -79.96 67.39 5.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.179 0.514 . . . . 10.0 110.828 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.51 155.16 23.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.053 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -26.32 63.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.0 0.428 . . . . 10.0 111.728 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.11 -26.51 64.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.399 . . . . 10.0 110.917 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.69 -51.91 4.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.616 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.613 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -89.45 95.86 10.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.502 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -109.8 156.14 40.33 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.084 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.26 -14.36 37.55 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.306 2.004 . . . . 10.0 110.407 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.44 -7.4 21.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.995 -1.002 . . . . 10.0 109.956 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.5 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.87 88.61 1.69 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.363 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.579 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 9.0 Cg_exo -74.25 147.74 37.91 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.732 2.288 . . . . 10.0 111.58 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.86 110.27 10.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.999 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.59 119.37 14.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.715 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.407 ' HB ' HD13 ' B' ' 7' ' ' ILE . 41.4 t -115.7 134.83 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.72 126.61 7.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.479 -0.867 . . . . 10.0 112.169 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.444 ' HB2' HG23 ' B' ' 7' ' ' ILE . 23.6 tp -111.12 105.6 14.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.908 0.385 . . . . 10.0 111.049 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.64 124.72 50.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.651 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -95.77 119.0 33.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.797 0.332 . . . . 10.0 110.116 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 18.9 ttp180 -79.66 78.8 6.2 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.923 -0.581 . . . . 10.0 111.099 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -98.52 129.65 45.09 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.692 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -68.18 150.08 48.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.988 -0.551 . . . . 10.0 109.768 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 70.11 7.62 6.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.561 0.538 . . . . 10.0 110.832 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 86' ' ' GLU . 7.0 m -123.12 132.89 54.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.141 -179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -100.46 -4.26 29.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.43 . . . . 10.0 111.011 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.489 ' H ' HG22 ' B' ' 84' ' ' THR . 37.4 tt0 -62.05 -24.63 67.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.686 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.98 74.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.871 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.65 -14.38 60.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.807 0.336 . . . . 10.0 111.666 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 51.2 m -84.18 -28.31 27.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.134 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.658 HG12 ' HB2' ' B' ' 10' ' ' HIS . 22.6 mt -94.51 -25.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.531 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.464 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 43.2 tt0 -69.41 112.63 12.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.67 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' B' ' 95' ' ' SER . 14.4 Cg_exo -72.0 -10.95 26.84 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.262 2.642 . . . . 10.0 111.416 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.52 ' HE1' HE22 ' B' ' 49' ' ' GLN . 54.6 t80 -74.85 -33.17 62.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.243 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -102.51 -40.17 6.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.549 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.603 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 6.8 m -119.43 142.63 32.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.535 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.38 152.97 80.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.765 2.31 . . . . 10.0 111.99 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.43 126.35 22.18 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.084 2.522 . . . . 10.0 112.193 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -66.14 112.71 4.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.787 -0.642 . . . . 10.0 111.77 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 32.2 tp -139.34 120.57 9.77 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.498 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.84 128.59 31.08 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.069 2.513 . . . . 10.0 112.076 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -59.62 -31.78 69.81 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.949 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.455 ' HB ' HG12 ' A' ' 29' ' ' VAL . 19.3 m -71.03 -17.55 20.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.19 0.519 . . . . 10.0 111.338 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.418 ' HG2' HG23 ' B' ' 102' ' ' VAL . 81.0 mmm -122.56 58.29 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.664 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 23.4 ttpt -135.02 -54.48 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.492 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -75.55 60.36 5.81 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.612 2.208 . . . . 10.0 112.218 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -123.44 -156.68 0.72 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.157 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.579 ' HB2' HE22 ' B' ' 118' ' ' GLN . 16.4 t0 -113.15 172.53 6.89 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.923 -0.311 . . . . 10.0 110.443 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 15.9 m -99.97 136.28 40.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.058 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.34 -144.99 9.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.563 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -35.95 11.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.925 0.393 . . . . 10.0 110.655 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.597 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 49.9 m -80.59 158.37 25.75 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.382 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . 0.409 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.65 123.71 20.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.908 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 73.17 5.6 5.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.761 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.597 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 45.6 tt0 -71.6 131.5 43.3 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 179.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -110.36 138.93 46.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.077 0.465 . . . . 10.0 111.529 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -108.88 111.21 22.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.807 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.575 ' H ' HD11 ' C' ' 81' ' ' ILE . 2.6 t -81.17 123.94 38.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.754 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.579 HE22 ' HB2' ' B' ' 107' ' ' ASP . 24.0 mp0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.176 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.147 0.498 . . . . 10.0 110.798 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.938 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 75.6 tttt -108.88 122.83 48.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.91 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.496 HD22 ' HE2' ' C' ' 44' ' ' PHE . 25.1 mt -101.32 120.46 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.534 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.693 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.6 mt -105.65 115.81 48.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -87.13 173.69 9.09 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.919 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.9 m -68.17 -21.19 64.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.244 0.545 . . . . 10.0 110.704 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.81 -8.4 56.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.685 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.41 12.09 73.71 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.573 -0.822 . . . . 10.0 111.461 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . 0.404 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -81.04 134.46 35.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.938 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 6.7 mt-10 -103.56 106.93 17.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.265 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -98.31 109.99 22.65 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.714 0.292 . . . . 10.0 111.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.593 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 14.6 mm -94.38 112.81 27.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.39 133.74 42.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.718 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.895 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.6 tttt -59.3 128.64 38.12 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -53.88 -35.19 61.3 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.239 0.337 . . . . 10.0 111.674 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -56.74 -40.28 75.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.145 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -86.32 -33.33 20.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.066 0.46 . . . . 10.0 110.084 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.86 -40.04 93.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.344 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.34 -47.18 86.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.309 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.442 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.0 OUTLIER -65.32 -40.06 93.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.691 179.495 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -65.29 -36.72 84.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.167 0.508 . . . . 10.0 109.824 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.27 -6.58 86.46 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.268 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -79.12 -27.33 42.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -83.38 143.32 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -66.49 95.42 0.32 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.471 . . . . 10.0 111.317 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -98.85 -171.3 2.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.144 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.525 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.8 mmm -79.59 31.81 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.847 0.356 . . . . 10.0 111.952 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 16.3 tp -66.17 -39.23 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.316 0.579 . . . . 10.0 110.016 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.51 7.04 24.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.593 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.95 -64.72 3.71 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.655 -0.702 . . . . 10.0 112.583 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.99 173.4 8.39 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.473 2.116 . . . . 10.0 111.666 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.96 -63.64 5.14 Favored Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.968 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -140.04 125.02 18.5 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.892 0.377 . . . . 10.0 110.134 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -88.25 110.16 20.51 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.287 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.5 152.82 28.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.218 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . 0.515 ' H ' ' HG3' ' C' ' 36' ' ' GLU . 1.5 mt-10 -62.33 -33.93 75.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.231 0.539 . . . . 10.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.58 -35.78 78.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.34 -0.846 . . . . 10.0 109.545 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.4 ' O ' HG22 ' C' ' 42' ' ' VAL . 41.7 tp10 -77.36 -22.84 51.12 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.452 -0.795 . . . . 10.0 110.023 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -73.86 -34.31 64.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.19 0.519 . . . . 10.0 109.739 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -70.73 -47.26 60.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.756 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.693 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.5 mt-10 -133.0 97.22 3.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.743 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.4 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.5 t -83.11 125.77 40.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.07 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -94.14 111.34 23.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.935 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.496 ' HE2' HD22 ' C' ' 3' ' ' LEU . 64.7 m-85 -102.08 110.7 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.399 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -101.06 144.9 29.42 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.799 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 69.71 22.7 6.02 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.86 0.725 . . . . 10.0 110.491 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 76.6 mt -131.51 107.21 14.43 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.335 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -64.72 156.64 60.38 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 123.069 2.513 . . . . 10.0 112.249 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.6 p -69.12 -34.89 75.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.577 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -35.77 76.47 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.688 0.625 . . . . 10.0 112.688 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.436 ' O ' HG23 ' C' ' 55' ' ' VAL . 32.9 m -87.37 -31.37 5.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.401 -0.52 . . . . 10.0 111.209 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.68 -33.89 75.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.277 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -40.59 98.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.823 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . 0.491 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 60.0 tttp -64.49 -37.97 89.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.436 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.0 t -63.83 -46.25 94.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.83 -43.19 98.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.852 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.16 -38.78 91.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.874 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.596 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 83.5 t80 -64.6 -42.88 95.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.525 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.476 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.5 m-85 -62.37 -44.86 95.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.541 . . . . 10.0 109.912 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 29.1 m -60.0 -43.3 95.28 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.992 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -63.65 -42.17 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.173 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 12.6 tptt -64.3 -37.27 86.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.131 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.476 HG23 ' O ' ' C' ' 59' ' ' PHE . 55.6 t -60.28 -50.31 80.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.8 mmt180 -70.78 -31.27 67.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.442 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -62.52 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.091 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -75.7 -15.94 60.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.966 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.04 -55.77 4.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.945 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.5 p -145.95 -34.31 0.31 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.693 0.627 . . . . 10.0 112.693 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.469 ' O ' HG12 ' C' ' 72' ' ' ILE . 9.8 m -78.4 44.4 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.106 0.479 . . . . 10.0 112.216 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -18.35 26.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.552 0.691 . . . . 10.0 109.796 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . 0.466 ' H ' ' HG2' ' C' ' 71' ' ' GLU . 1.6 pt-20 -89.1 8.46 29.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.513 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.469 HG12 ' O ' ' C' ' 69' ' ' SER . 18.0 pt -111.21 163.92 16.2 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.14 149.9 82.34 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.466 2.111 . . . . 10.0 112.676 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -70.66 165.45 22.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.32 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -45.31 128.66 5.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.285 0.365 . . . . 10.0 111.151 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.76 5.4 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.077 2.518 . . . . 10.0 112.482 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 16' ' ' LEU . 7.2 pt -79.54 57.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.5 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -118.8 -55.22 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.483 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 39.6 Cg_exo -58.47 107.59 0.34 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.987 1.791 . . . . 10.0 112.187 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -72.61 57.02 0.4 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.761 -0.654 . . . . 10.0 112.6 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . 0.575 HD11 ' H ' ' B' ' 117' ' ' VAL . 8.1 mm -125.24 -4.35 5.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.348 0.594 . . . . 10.0 109.919 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.68 -43.7 68.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.566 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 29.8 tp -67.1 -29.9 69.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.379 0.609 . . . . 10.0 109.425 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.481 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 12.3 mp0 -64.23 -34.74 78.8 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.459 178.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.649 ' HB3' HD21 ' A' ' 8' ' ' LEU . 89.4 mt -76.47 -27.82 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.265 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.459 HD12 HD12 ' C' ' 83' ' ' LEU . 94.6 mt -73.06 -15.69 61.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.776 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 51.9 ttp -61.91 -26.12 67.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.695 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.69 83.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.76 -58.21 0.44 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.902 0.751 . . . . 10.0 112.59 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -82.65 50.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.516 0.674 . . . . 10.0 110.337 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.519 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.87 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.644 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.76 -0.136 . . . . 10.0 112.76 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -68.63 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.69 0.626 . . . . 10.0 112.69 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.517 HD22 ' HD2' ' C' ' 91' ' ' PHE . 4.3 mp -66.3 -21.67 66.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -51.73 -31.96 28.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.335 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -115.49 -35.0 4.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.007 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.506 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.1 mt -63.0 -36.07 82.34 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.546 0.573 . . . . 10.0 112.546 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.54 72.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.682 0.277 . . . . 10.0 111.257 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.1 tp -68.31 -32.04 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.162 0.506 . . . . 10.0 110.667 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.07 -18.1 50.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.741 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 -11.68 29.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.055 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.558 ' HA ' HG22 ' C' ' 77' ' ' ILE . 12.7 tp -165.21 113.56 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.221 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.8 mt -90.14 78.72 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 71.0 tttt -107.37 102.55 44.58 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.643 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -91.99 53.1 0.69 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.946 2.431 . . . . 10.0 111.697 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -100.63 -177.15 3.4 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.918 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -86.77 152.7 22.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.767 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.444 HG23 HD22 ' A' ' 32' ' ' LEU . 29.8 mm -120.49 105.92 17.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.679 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.002 ' HG2' ' HD2' ' A' ' 24' ' ' PRO . 4.4 tttp -120.2 146.23 42.03 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 1.002 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 33.1 Cg_exo -32.87 133.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 124.227 3.285 . . . . 10.0 113.5 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.792 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 31.0 Cg_endo -62.24 155.27 57.73 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 123.216 2.611 . . . . 10.0 113.401 -178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 122.96 63.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.477 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.78 -16.11 51.27 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.457 2.771 . . . . 10.0 112.893 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -42.26 98.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 10.0 110.121 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.4 t -120.99 -113.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.709 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.7 ptp180 -171.9 57.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.062 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.46 ' HG3' ' HG2' ' C' ' 84' ' ' GLU . 20.3 tttm -152.8 151.92 31.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.134 -179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.792 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.8 pp -72.0 156.28 39.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.683 0.277 . . . . 10.0 110.977 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -96.43 161.82 13.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.475 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -101.69 124.95 48.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.657 -0.498 . . . . 10.0 109.657 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.654 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 9.5 t70 -174.91 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.109 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.7 -64.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.516 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.0 m0 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.141 -0.933 . . . . 10.0 109.281 179.796 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmm . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 120.831 0.348 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -177.93 104.1 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.657 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.508 HG11 HD13 ' B' ' 57' ' ' LEU . 55.5 t -119.56 123.66 71.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.282 0.563 . . . . 10.0 111.78 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.01 116.67 31.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.237 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.656 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -126.65 151.33 48.2 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.182 0.515 . . . . 10.0 112.326 -179.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 41.7 mtm -122.3 104.58 9.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.137 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.48 HD11 HD12 ' B' ' 5' ' ' LEU . 44.7 mm -81.75 104.24 10.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.58 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.4 ttt180 -101.54 104.31 15.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.0 ttp85 -91.93 69.79 5.48 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.493 ' CE1' ' HE2' ' B' ' 11' ' ' LYS . 6.7 t-160 66.98 -79.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.343 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.493 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 71.1 mmtt -110.03 -11.29 14.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.643 0.259 . . . . 10.0 111.345 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 102.93 12.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.646 -0.252 . . . . 10.0 110.887 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 17.8 m -101.72 124.29 47.12 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.872 0.368 . . . . 10.0 110.914 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.452 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.1 mt -116.41 122.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.987 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -84.66 122.65 29.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.851 0.358 . . . . 10.0 110.144 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.656 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -117.96 130.17 56.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.491 . . . . 10.0 111.634 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -110.74 103.89 12.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.97 -168.65 2.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.453 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -129.49 161.22 30.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 3.8 mp0 -54.26 -28.13 39.56 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.5 m -68.08 -25.43 65.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.4 m -73.24 137.4 44.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.619 0.247 . . . . 10.0 110.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 73.6 p -87.98 167.28 13.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.875 0.369 . . . . 10.0 111.181 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.751 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 70.7 t -65.1 -35.53 75.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.102 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . 0.672 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 52.5 t80 -62.19 -34.96 77.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.172 0.51 . . . . 10.0 110.517 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.406 ' O ' HG13 ' B' ' 30' ' ' ILE . 34.1 mt-10 -66.38 -31.17 71.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.847 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.917 HD11 HD21 ' B' ' 57' ' ' LEU . 63.8 mt -66.32 -43.98 84.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 10.0 109.949 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.07 -34.66 75.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -67.96 -32.96 73.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.447 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.406 HG13 ' O ' ' B' ' 26' ' ' GLU . 82.7 mt -69.5 -46.69 75.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -63.48 -35.07 71.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.542 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.6 tm-20 -60.53 -38.03 83.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.291 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.15 1.05 71.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.729 -0.748 . . . . 10.0 112.946 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.56 -56.05 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.891 0.377 . . . . 10.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.75 -13.72 44.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.503 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 90.9 mttt 61.7 31.64 18.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.728 -0.669 . . . . 10.0 112.166 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -105.04 142.86 25.53 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.654 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.16 125.22 17.48 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.893 2.395 . . . . 10.0 112.496 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.542 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 30.5 Cg_endo -64.11 -21.36 67.91 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.953 2.435 . . . . 10.0 112.322 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.31 -29.75 70.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -96.11 -4.07 43.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.78 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.9 135.19 35.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.935 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.486 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 80.8 mmt-85 -127.14 110.21 12.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.81 111.66 23.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.904 0.383 . . . . 10.0 110.661 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -107.44 109.95 21.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.758 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.483 ' HB3' HD21 ' B' ' 51' ' ' LEU . 7.8 tttt -118.52 134.01 55.42 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 62.35 32.0 17.1 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.253 0.549 . . . . 10.0 109.715 -178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 67.93 10.54 7.87 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.021 -0.991 . . . . 10.0 112.066 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -124.59 151.37 44.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.017 0.437 . . . . 10.0 111.303 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.8 tp -74.83 126.44 30.95 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.185 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.549 ' HB3' HG21 ' B' ' 24' ' ' VAL . 89.4 mt -72.48 153.54 41.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.899 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -93.1 112.34 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.961 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.751 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.7 m-20 -60.31 -27.24 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.137 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.66 -12.79 83.25 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.942 -0.647 . . . . 10.0 112.714 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -102.27 161.49 13.66 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.876 0.369 . . . . 10.0 111.038 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.6 p -90.97 172.9 8.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.885 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.917 HD21 HD11 ' B' ' 27' ' ' LEU . 87.1 mt -62.39 -29.61 70.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.525 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.49 -43.96 98.63 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.131 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -75.08 -15.21 60.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.76 0.282 . . . . 10.0 111.76 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 53.5 m -95.84 15.35 20.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.825 0.345 . . . . 10.0 111.782 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.37 41.56 96.46 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.017 -0.611 . . . . 10.0 113.115 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.502 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 23.4 m-85 -101.97 48.62 0.87 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.002 0.43 . . . . 10.0 110.228 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.01 149.79 49.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.512 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -22.69 65.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.977 0.418 . . . . 10.0 111.717 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.2 mm-40 -72.81 -32.03 65.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.066 0.46 . . . . 10.0 110.418 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.81 -37.97 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.797 179.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.5 92.14 3.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.508 -0.769 . . . . 10.0 109.138 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' OE1' ' B' ' 70' ' ' GLN . 7.8 mtt180 -106.74 163.5 16.85 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.775 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 29.0 Cg_endo -65.23 -16.27 53.97 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.334 2.023 . . . . 10.0 111.2 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.412 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -107.34 1.28 23.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.613 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.515 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -161.8 82.84 1.79 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.577 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.534 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -74.88 143.43 29.48 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.923 2.416 . . . . 10.0 111.987 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.77 118.05 13.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.805 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.76 123.26 26.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.44 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.456 ' HB ' HD13 ' B' ' 7' ' ' ILE . 34.9 t -122.99 136.32 60.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.26 134.38 12.4 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.73 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.47 102.76 10.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.897 0.38 . . . . 10.0 111.838 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.486 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.43 130.74 38.02 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -111.59 116.48 30.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.629 0.252 . . . . 10.0 110.998 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -70.99 104.25 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.179 0.514 . . . . 10.0 111.005 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -122.01 126.97 49.72 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.804 -0.634 . . . . 10.0 109.367 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -66.29 133.27 50.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.953 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 76.26 -22.38 0.28 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.265 0.839 . . . . 10.0 113.265 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.4 m -85.25 106.39 16.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.994 0.426 . . . . 10.0 110.429 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -77.51 -4.36 45.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.163 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -60.07 -30.95 69.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.916 0.388 . . . . 10.0 110.897 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.54 -34.2 66.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.964 -0.562 . . . . 10.0 112.471 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.76 -30.04 69.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.4 m -79.6 -12.35 59.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.701 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 mt -100.29 -0.85 10.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 10.0 111.098 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 32.9 tt0 -97.81 110.89 57.36 Favored Pre-proline 0 C--N 1.323 -0.553 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -70.73 2.49 4.02 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.257 2.638 . . . . 10.0 112.383 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.553 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 19.0 t80 -94.1 -18.67 21.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.213 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.4 p -118.94 -42.11 2.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.165 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.3 m -106.52 153.33 40.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.991 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.04 159.09 23.91 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.382 2.055 . . . . 10.0 111.366 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.66 126.23 20.01 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.585 2.19 . . . . 10.0 111.591 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -70.99 103.81 2.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.505 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.6 tp -131.38 126.54 21.33 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.447 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.646 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 51.1 Cg_exo -54.67 134.07 60.4 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.819 2.346 . . . . 10.0 111.768 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.01 -37.64 88.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.272 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.6 m -73.51 -15.95 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.324 0.583 . . . . 10.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.646 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 89.7 mmm -112.78 39.14 2.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.508 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.63 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.2 ttpt -115.76 -53.74 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.169 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 9.9 Cg_exo -73.11 69.77 3.85 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 122.314 2.01 . . . . 10.0 111.553 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.2 mt-30 -137.1 170.68 15.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.608 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 4.7 t0 -85.63 175.54 8.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.785 0.326 . . . . 10.0 110.794 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.3 m -96.63 143.65 27.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.348 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . 0.5 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.18 -153.21 29.67 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.213 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -33.73 13.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.212 0.529 . . . . 10.0 110.877 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.515 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 50.8 m -89.09 163.41 15.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.879 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.61 132.13 45.72 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.041 -0.725 . . . . 10.0 109.041 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.85 -0.28 3.41 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.709 0.63 . . . . 10.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.5 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 35.7 tt0 -76.49 131.61 39.11 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -115.48 151.33 34.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.053 0.454 . . . . 10.0 111.365 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -118.21 106.02 12.38 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.046 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.623 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -69.52 127.86 32.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.809 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' B' ' 106' ' ' GLN . 11.6 mp0 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.412 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.134 0.492 . . . . 10.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.68 ' HE2' HG12 ' C' ' 4' ' ' ILE . 61.5 tttt -105.42 121.93 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.586 -0.734 . . . . 10.0 110.847 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.632 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.1 mt -95.7 115.06 26.88 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.724 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.9 mt -98.7 109.78 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.5 p -83.33 170.82 14.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.73 0.3 . . . . 10.0 110.975 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.1 m -67.84 -19.8 65.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.886 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -82.91 -4.87 58.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.079 0.466 . . . . 10.0 110.296 179.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.22 65.57 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.406 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.96 130.49 34.53 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -95.17 117.16 29.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.238 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.632 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 87.9 m-85 -108.25 106.47 16.65 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.686 0.279 . . . . 10.0 110.882 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.452 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.3 mm -94.34 116.54 35.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.63 136.17 43.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.591 0.234 . . . . 10.0 110.88 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -58.62 129.37 41.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 26.9 ttt180 -57.94 -25.53 61.04 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 112.683 0.623 . . . . 10.0 112.683 -178.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -55.17 -49.81 70.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.198 0.523 . . . . 10.0 110.149 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -77.95 -32.14 51.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.864 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -63.06 -37.22 86.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.342 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 64.8 mt -59.98 -52.4 65.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.978 0.418 . . . . 10.0 110.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.47 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.7 m -62.1 -44.21 97.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.6 m -62.1 -38.78 90.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.996 0.427 . . . . 10.0 110.848 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.29 -10.11 78.16 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.066 -0.588 . . . . 10.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 23.6 m -86.5 -25.17 25.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.249 0.547 . . . . 10.0 109.582 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . 0.556 HG22 ' H ' ' C' ' 25' ' ' LYS . 6.5 mt -75.1 170.61 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.883 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . 0.556 ' H ' HG22 ' C' ' 24' ' ' ILE . 31.8 tttp -73.29 78.33 1.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 10.0 110.681 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.14 9.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.796 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.644 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 87.3 mmm -80.31 45.18 0.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.712 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tt -70.24 -37.5 74.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.045 0.45 . . . . 10.0 110.233 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.73 12.91 13.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.841 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.3 -60.97 6.13 Favored Glycine 0 CA--C 1.523 0.537 0 CA-C-N 115.789 -0.641 . . . . 10.0 113.027 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -67.91 -178.31 1.61 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.621 2.214 . . . . 10.0 112.253 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.3 -49.08 68.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.891 -0.671 . . . . 10.0 112.158 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -149.69 133.38 16.81 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.23 100.8 12.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.032 0.444 . . . . 10.0 110.352 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.48 159.13 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.042 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.3 -28.59 63.19 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -61.83 -42.54 99.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.046 0.45 . . . . 10.0 110.083 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.492 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.2 tp10 -72.8 -20.29 61.18 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -79.78 -32.0 40.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.209 0.528 . . . . 10.0 109.621 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -75.04 -51.05 14.51 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.724 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.7 mt-10 -131.55 106.63 8.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.76 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.492 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -92.82 115.07 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.535 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -90.15 113.75 25.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.979 0.419 . . . . 10.0 111.176 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.56 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.4 m-85 -102.26 103.13 13.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -92.35 148.44 22.13 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 69.1 17.57 8.45 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.808 0.693 . . . . 10.0 110.716 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.436 HD12 ' HB3' ' C' ' 44' ' ' PHE . 77.8 mt -129.84 108.17 16.91 Favored Pre-proline 0 C--O 1.237 0.425 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.793 -179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.33 149.39 91.36 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.069 2.512 . . . . 10.0 112.504 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 6.4 p -62.77 -40.07 96.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.576 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.72 -53.15 58.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 10.0 112.257 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.2 m -68.21 -34.47 66.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.904 -0.319 . . . . 10.0 111.217 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.17 -30.8 71.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.946 0.403 . . . . 10.0 110.332 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -62.97 -40.57 98.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.499 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -68.1 -35.13 77.66 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.284 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 61.4 t -63.18 -46.32 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.619 179.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.31 -41.59 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.902 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 63.3 mtm -65.66 -40.76 92.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.914 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.506 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.6 t80 -64.28 -42.22 96.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.603 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.42 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.3 m-85 -62.94 -44.5 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.278 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 43.4 m -58.88 -43.09 90.86 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.488 0.661 . . . . 10.0 109.794 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.59 -43.43 84.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.117 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -61.42 -39.68 91.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.362 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.47 HG22 ' HB ' ' C' ' 20' ' ' THR . 46.4 t -60.43 -45.03 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.416 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -77.31 -38.83 49.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.72 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.587 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -55.21 -52.39 63.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.491 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.7 50.59 1.92 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.599 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -158.56 -54.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.438 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -139.77 -38.08 0.48 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.279 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.587 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -80.06 40.18 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.917 0.389 . . . . 10.0 111.769 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.7 -8.03 56.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.291 0.567 . . . . 10.0 110.244 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -79.72 -27.71 40.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.149 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.674 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 27.5 pt -92.22 165.3 20.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.842 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.674 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 70.4 Cg_endo -73.68 -178.33 3.68 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.329 2.019 . . . . 10.0 113.422 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -78.58 173.37 12.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.32 -0.854 . . . . 10.0 108.907 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.31 129.77 51.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 123.104 0.252 . . . . 10.0 110.445 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.3 123.02 10.35 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.121 2.548 . . . . 10.0 112.534 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.558 HG22 ' HA ' ' A' ' 16' ' ' LEU . 23.0 pt -82.09 38.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.494 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.468 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -92.57 -57.03 0.24 Allowed Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 10.0 112.081 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 37.8 Cg_endo -66.78 103.48 0.71 Allowed 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.119 1.879 . . . . 10.0 111.189 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.648 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 26.4 mt-10 -76.71 51.93 0.79 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.708 0.633 . . . . 10.0 112.708 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 27.8 mm -118.34 -9.18 11.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.479 0.657 . . . . 10.0 110.096 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.3 -29.31 66.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.255 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.483 HD22 ' HG2' ' A' ' 18' ' ' LYS . 11.6 tp -73.25 -26.14 60.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.181 0.515 . . . . 10.0 110.165 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.498 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 5.4 mp0 -63.7 -27.36 69.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.715 179.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 8' ' ' LEU . 43.1 mt -76.85 -23.87 52.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.897 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 53.1 tp -72.53 -12.63 61.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.516 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 48.3 ttp -62.53 -29.13 70.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.983 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.54 78.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.687 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.81 -51.36 0.68 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.934 0.716 . . . . 10.0 112.934 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -83.76 34.32 0.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.221 0.534 . . . . 10.0 110.773 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.517 ' HD2' HD22 ' A' ' 8' ' ' LEU . 4.1 t80 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.517 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 112.102 -0.399 . . . . 10.0 112.102 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.73 -61.37 2.23 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.52 0.563 . . . . 10.0 112.52 -179.063 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.549 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.5 tp -63.6 -30.65 71.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.348 -178.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.41 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 11.8 tt0 -56.7 -26.29 56.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.926 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -106.79 -38.64 6.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.443 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.5 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 62.3 mt -59.6 -39.87 85.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.942 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.06 -38.44 72.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.328 . . . . 10.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.38 -34.25 76.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.102 0.477 . . . . 10.0 110.785 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.9 0.74 46.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.924 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.47 -48.06 3.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.162 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.768 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.1 OUTLIER -140.08 110.02 6.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.89 -179.697 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.8 mt -76.17 114.89 16.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.702 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.812 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 53.2 tttt -126.6 92.03 45.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.873 0.368 . . . . 10.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -83.26 48.52 2.71 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.952 2.434 . . . . 10.0 111.979 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 54.3 mttt -93.15 -170.03 2.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.03 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -96.55 168.4 10.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.02 0.438 . . . . 10.0 111.612 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.0 mm -111.97 151.04 14.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.173 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.932 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -175.28 138.88 0.58 Allowed Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 179.213 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.596 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 53.3 Cg_exo -40.4 137.74 1.46 Allowed 'Trans proline' 0 C--O 1.239 0.566 0 C-N-CA 123.354 2.702 . . . . 10.0 113.058 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.4 Cg_endo -60.57 136.0 64.4 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.044 2.496 . . . . 10.0 112.059 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 31' ' ' LYS . 0.3 OUTLIER -76.18 123.65 88.05 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.643 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.0 -7.65 20.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.001 2.467 . . . . 10.0 112.466 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -36.6 78.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 10.0 111.034 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.571 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.1 t -132.88 -113.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.724 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.571 ' HG2' HG12 ' A' ' 29' ' ' VAL . 3.8 ptp180 -162.16 56.14 0.24 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.211 0.529 . . . . 10.0 110.912 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 tttm -151.57 155.19 37.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.863 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 1.1 pp -84.55 151.69 24.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.705 -0.479 . . . . 10.0 109.705 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HD2' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -86.97 175.92 7.9 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.633 -0.258 . . . . 10.0 110.386 -179.592 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 0.8 OUTLIER -124.47 119.53 29.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.652 0.263 . . . . 10.0 110.845 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.932 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -165.93 -70.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.269 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 175.37 -56.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.454 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.414 ' SD ' ' HD2' ' B' ' 19' ' ' LYS . 9.0 tmm? . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.831 0.348 . . . . 10.0 110.708 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.25 141.91 30.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.826 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.549 ' CG2' ' HG3' ' B' ' 20' ' ' GLU . 76.4 t -128.8 126.78 65.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.128 0.489 . . . . 10.0 110.826 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.405 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 54.4 m-85 -116.39 118.04 31.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.888 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.862 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -131.37 160.75 34.14 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.692 0.282 . . . . 10.0 111.13 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.629 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 58.1 mtm -127.83 108.63 10.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.863 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.599 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.9 mm -82.26 102.71 8.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.5 ttt180 -100.51 105.18 16.6 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.534 0.568 . . . . 10.0 112.534 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.541 ' HB2' HD23 ' B' ' 77' ' ' LEU . 20.6 ttp85 -94.14 82.67 4.17 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.959 -1.497 . . . . 10.0 106.959 177.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.538 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.2 t-80 66.79 -86.15 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.204 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -119.65 6.88 11.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.151 0.5 . . . . 10.0 111.102 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -105.86 95.19 5.62 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 6.4 m -95.09 117.13 29.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.016 0.436 . . . . 10.0 110.943 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.548 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 52.8 mt -108.17 117.23 53.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.555 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -74.04 116.68 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.862 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -107.7 114.22 28.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.234 0.54 . . . . 10.0 111.511 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.901 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 1.4 t70 -103.49 110.6 22.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -141.14 -159.78 1.0 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.979 0.419 . . . . 10.0 111.937 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.414 ' HD2' ' SD ' ' B' ' 1' ' ' MET . 38.0 mmtm -129.86 161.27 31.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.344 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.549 ' HG3' ' CG2' ' B' ' 3' ' ' VAL . 14.1 mt-10 -61.56 -24.49 66.68 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.663 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -16.61 59.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.303 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . 0.469 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 19.2 m -76.04 144.03 41.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.501 0.191 . . . . 10.0 111.015 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 37.9 p -90.15 168.17 12.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.829 0.347 . . . . 10.0 111.042 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.401 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 79.4 t -67.42 -35.59 73.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.852 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 69.2 t80 -63.57 -32.81 74.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.1 0.476 . . . . 10.0 110.515 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.71 -34.08 77.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.417 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.726 HD11 HD21 ' B' ' 57' ' ' LEU . 69.9 mt -63.38 -44.65 94.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -62.1 -35.06 77.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.529 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -66.76 -34.38 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.222 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 85.8 mt -71.18 -45.55 70.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.55 -36.26 72.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.085 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -59.89 -39.82 86.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.66 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.64 -10.17 84.77 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.67 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.5 mt -103.04 -51.75 8.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 111.755 0.28 . . . . 10.0 111.755 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 58.5 mt -89.15 -13.06 39.28 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 57.83 43.5 21.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.399 0.618 . . . . 10.0 112.021 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -127.22 140.68 38.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.259 -0.882 . . . . 10.0 110.033 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -48.99 119.98 4.97 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.403 2.735 . . . . 10.0 112.986 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.72 -16.87 42.43 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.113 2.542 . . . . 10.0 112.258 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.71 -32.78 74.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.567 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -100.74 11.29 39.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.823 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -90.58 126.99 36.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' B' ' 43' ' ' ARG . 37.4 mmt-85 -110.98 123.31 49.93 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.3 121.49 45.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.622 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -119.97 129.84 54.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.814 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.513 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.2 tttm -130.0 129.45 43.75 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 64.93 25.98 12.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.011 0.434 . . . . 10.0 110.287 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 71.98 19.06 4.8 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.27 -0.877 . . . . 10.0 111.235 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -125.94 152.96 44.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.281 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -78.1 137.35 38.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.378 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' B' ' 46' ' ' LYS . 92.8 mt -85.98 165.22 16.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.191 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -112.07 121.18 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.684 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.529 ' HB3' ' HB2' ' B' ' 25' ' ' PHE . 44.7 m-20 -61.83 -28.99 69.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.203 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.98 -5.17 86.39 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.552 -0.832 . . . . 10.0 113.431 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -104.66 157.51 17.13 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.112 0.456 . . . . 10.0 111.433 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.0 p -89.25 165.14 14.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.613 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.726 HD21 HD11 ' B' ' 27' ' ' LEU . 45.8 mt -59.04 -42.48 90.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.313 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.35 -31.62 66.6 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.046 -0.597 . . . . 10.0 112.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -79.73 -23.73 42.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.028 0.442 . . . . 10.0 110.914 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 52.0 m -86.66 0.8 53.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.6 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.77 8.88 57.92 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.977 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.514 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 59.6 m-85 -80.6 98.51 7.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.888 0.375 . . . . 10.0 110.125 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.89 164.41 23.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.7 m -67.86 -10.94 57.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 10.0 112.048 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -77.93 -37.58 47.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.126 0.489 . . . . 10.0 110.066 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -48.08 6.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.852 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -94.26 96.47 9.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.784 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 1.0 OUTLIER -107.34 161.14 24.02 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.547 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 30.1 Cg_endo -65.41 -15.86 51.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.478 2.119 . . . . 10.0 111.481 178.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.75 2.14 23.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.987 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.84 85.91 1.25 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.576 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.629 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.1 Cg_exo -73.29 147.6 42.27 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.739 2.293 . . . . 10.0 111.334 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.97 116.23 11.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.02 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.74 117.13 11.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.443 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.599 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.5 t -117.01 133.68 62.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.67 128.7 9.24 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.657 -0.782 . . . . 10.0 112.409 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 9' ' ' ARG . 23.7 tp -113.11 114.35 26.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 10.0 111.022 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.95 124.61 53.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.657 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -100.5 113.58 26.48 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -77.32 112.74 14.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.963 0.411 . . . . 10.0 111.54 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.54 147.83 52.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.524 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 83' ' ' ASP . 32.0 t70 -71.46 139.62 49.71 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.07 -0.344 . . . . 10.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' B' ' 82' ' ' ASP . 19.4 t70 77.92 -31.0 0.16 Allowed 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.603 0.564 . . . . 10.0 112.224 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.9 m -83.3 95.11 8.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 10.0 111.059 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -74.23 -4.01 33.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.202 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.475 ' O ' HG13 ' B' ' 90' ' ' ILE . 35.4 tt0 -56.26 -32.44 64.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.663 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.07 76.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.209 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.2 mt -72.68 -18.76 61.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.978 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.15 -11.46 38.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.405 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.538 HG12 ' HB2' ' B' ' 10' ' ' HIS . 53.4 mt -101.44 -31.59 3.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.431 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.61 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 39.2 tt0 -66.03 114.15 15.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.484 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.516 ' HA ' ' O ' ' B' ' 95' ' ' SER . 8.4 Cg_exo -74.0 -0.65 9.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.1 2.533 . . . . 10.0 111.354 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.61 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 12.7 t80 -86.66 -16.09 37.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.987 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.24 -42.88 2.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.859 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 10.5 m -113.23 150.49 43.1 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.83 154.95 66.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.593 2.195 . . . . 10.0 111.553 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.73 130.6 37.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.882 2.388 . . . . 10.0 112.496 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.97 102.22 1.95 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.909 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.7 tp -140.27 130.0 13.55 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.833 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.458 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 50.1 Cg_exo -56.41 131.77 47.75 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.992 2.461 . . . . 10.0 111.803 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . 0.983 ' HA ' ' HD3' ' B' ' 104' ' ' LYS . 27.6 t0 -65.6 -34.42 78.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.486 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -68.97 -20.36 24.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.286 0.565 . . . . 10.0 110.532 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.458 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 65.4 mmm -107.6 54.97 0.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.65 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.983 ' HD3' ' HA ' ' B' ' 101' ' ' ASP . 32.9 mtpt -133.62 -47.71 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.97 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.839 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 64.6 Cg_endo -72.95 45.23 0.88 Allowed 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.166 1.911 . . . . 10.0 113.493 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 8.6 mp0 -119.38 175.0 6.03 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.649 -0.501 . . . . 10.0 109.649 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -90.49 165.86 13.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.637 0.256 . . . . 10.0 110.379 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 50.7 m -89.99 143.85 26.42 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.211 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . 0.487 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -83.96 -150.75 11.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.259 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.26 -27.93 15.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.36 0.6 . . . . 10.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.924 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 0.7 OUTLIER -96.68 165.72 12.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.273 -0.876 . . . . 10.0 110.871 -179.347 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.79 138.18 46.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.612 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 68.52 4.79 4.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.823 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.487 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 34.9 tt0 -86.07 128.93 34.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -114.67 141.68 47.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.941 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.21 101.17 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.845 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 3.7 t -74.04 133.97 30.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.787 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.994 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.893 0.378 . . . . 10.0 110.923 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.435 ' HE2' HG12 ' C' ' 4' ' ' ILE . 44.9 tttt -108.84 113.8 27.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.961 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.531 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 26.2 mt -91.29 127.83 36.88 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.435 HG12 ' HE2' ' C' ' 2' ' ' LYS . 8.2 mt -113.14 120.61 63.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.489 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -94.31 166.52 12.04 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.126 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -1.24 11.83 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.198 0.444 . . . . 10.0 112.198 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -95.06 2.96 55.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.851 0.357 . . . . 10.0 110.216 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.06 33.54 57.0 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.78 -0.724 . . . . 10.0 111.433 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -108.65 128.4 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -97.02 121.67 39.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.896 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.531 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 81.7 m-85 -112.35 110.03 20.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.601 0.239 . . . . 10.0 110.585 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.548 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 21.6 mm -96.06 116.03 36.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.9 t -104.72 135.9 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.406 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.901 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 22.2 tttt -58.97 131.89 52.39 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 65.8 ttt180 -57.89 -34.86 70.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 10.0 112.013 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.436 ' HB2' ' HD3' ' C' ' 14' ' ' LYS . 31.3 mt-10 -56.78 -38.11 72.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.693 0.282 . . . . 10.0 111.411 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -82.96 -32.67 26.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.141 0.496 . . . . 10.0 110.083 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.82 -29.72 70.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.89 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.8 mt -59.29 -55.9 28.96 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.417 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.8 -40.1 96.32 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.283 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.0 m -62.2 -35.34 78.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.469 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.44 -18.18 79.95 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.092 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 14.0 m -79.76 -28.57 40.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.089 0.471 . . . . 10.0 109.765 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mt -74.53 149.76 7.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.158 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.61 113.47 6.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 10.0 110.414 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -134.06 177.57 7.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.871 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.517 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.4 mmm -78.87 38.06 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.894 0.378 . . . . 10.0 111.581 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.64 -37.73 85.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.23 0.538 . . . . 10.0 110.019 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.5 m -91.56 18.58 7.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.314 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.53 -60.55 5.74 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.671 -0.695 . . . . 10.0 112.834 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.84 172.02 7.71 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.356 2.038 . . . . 10.0 112.311 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.23 -55.18 27.74 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 115.885 -0.598 . . . . 10.0 113.167 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -149.67 110.48 4.3 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.505 -0.409 . . . . 10.0 111.11 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -77.27 90.6 3.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.087 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.4 171.83 14.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.137 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.07 -33.59 69.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.329 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -60.85 -44.13 97.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.156 0.503 . . . . 10.0 109.85 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.431 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.0 mp0 -72.6 -26.21 61.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.685 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 10.4 m -74.07 -35.41 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.248 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -76.48 -50.92 12.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.109 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.425 ' HB3' HD11 ' C' ' 4' ' ' ILE . 29.9 mt-10 -124.8 107.32 10.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.302 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.431 HG22 ' O ' ' C' ' 38' ' ' GLU . 3.4 t -92.89 103.66 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.972 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -90.14 119.48 30.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.977 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.609 ' HB3' HD12 ' C' ' 47' ' ' ILE . 87.1 m-85 -98.81 142.29 30.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.214 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -112.58 135.72 52.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.405 -0.362 . . . . 10.0 111.609 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 64.92 19.48 11.86 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.47 -0.786 . . . . 10.0 112.197 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.609 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.0 mt -114.74 107.46 50.57 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.396 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 45.2 Cg_exo -59.71 149.52 82.39 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 123.191 2.594 . . . . 10.0 112.377 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -65.01 -35.86 82.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.758 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -56.16 24.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.953 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.527 ' HB ' HD21 ' C' ' 85' ' ' LEU . 35.7 m -67.62 -33.3 61.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.354 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.63 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -59.66 -38.04 80.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -67.11 -32.6 73.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.355 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.84 -46.76 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -59.84 -41.45 91.39 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.702 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 59.7 mtm -68.51 -39.32 81.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.787 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.5 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.0 t80 -63.07 -44.84 94.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.718 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.27 -44.99 95.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.397 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 57.8 m -58.73 -41.98 87.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.865 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.43 -47.41 76.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.914 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -59.04 -40.93 86.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.866 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 42.2 t -57.96 -50.23 78.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.625 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.7 mmt85 -72.07 -38.82 69.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.949 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.451 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 79.2 t80 -58.03 -42.37 85.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.111 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.47 19.94 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.005 0.431 . . . . 10.0 111.513 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -128.4 -44.66 1.38 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.803 0.335 . . . . 10.0 111.543 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.98 -38.67 0.27 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.956 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.521 ' O ' HG12 ' C' ' 72' ' ' ILE . 0.7 OUTLIER -79.68 41.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.868 0.322 . . . . 10.0 111.868 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.66 -18.96 33.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.329 0.585 . . . . 10.0 110.247 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -73.0 -14.62 61.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.952 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.555 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 17.1 pt -101.03 160.45 26.64 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.555 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 65.1 Cg_endo -73.93 175.27 11.05 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.318 2.012 . . . . 10.0 113.015 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.41 172.52 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.485 -0.78 . . . . 10.0 109.508 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -49.66 126.36 17.82 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 122.457 0.303 . . . . 10.0 110.528 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.28 122.77 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.295 2.664 . . . . 10.0 113.029 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.768 HG22 ' HA ' ' A' ' 16' ' ' LEU . 5.7 pt -76.58 59.77 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.752 -0.658 . . . . 10.0 112.341 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.714 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -112.96 -59.12 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.714 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 12.0 Cg_exo -71.56 106.84 2.04 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.159 1.906 . . . . 10.0 111.682 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.812 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 2.3 pt-20 -73.46 50.69 0.32 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.049 -0.523 . . . . 10.0 112.372 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -110.17 19.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.71 0.767 . . . . 10.0 109.862 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.5 -42.43 18.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.062 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.35 -30.17 70.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.208 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 13.1 mp0 -59.7 -41.67 91.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.998 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.549 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.3 mt -78.77 -38.04 39.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.705 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 2.9 tt -61.44 -32.37 72.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.357 -0.838 . . . . 10.0 110.846 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 33.0 ttp -59.6 -19.85 51.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.989 -0.55 . . . . 10.0 112.083 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.46 -32.49 71.44 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.54 -58.89 0.42 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 124.021 0.826 . . . . 10.0 113.223 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -82.04 39.45 0.57 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.164 0.507 . . . . 10.0 111.025 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.678 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.492 -0.243 . . . . 10.0 112.492 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.564 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.69 -66.18 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 -179.082 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 14.2 tp -63.98 -27.26 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.499 -178.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -55.34 -29.7 58.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.601 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -102.25 -40.43 6.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.96 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.611 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.4 mt -57.66 -36.11 71.44 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.498 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.48 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.72 0.295 . . . . 10.0 110.586 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.48 -31.22 70.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.383 0.611 . . . . 10.0 110.127 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.46 -18.18 61.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.819 . . . . 10.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.57 -53.21 4.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.24 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.89 132.62 21.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 111.593 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.2 mt -88.97 114.46 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 69.5 tttt -116.38 100.47 53.48 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.401 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -89.41 32.9 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.121 2.548 . . . . 10.0 111.826 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -92.23 170.4 9.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.004 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -83.23 160.51 21.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.906 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.6 mm -108.98 153.78 10.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.441 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.032 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.6 OUTLIER -167.18 133.76 1.85 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.88 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 44.3 Cg_exo -39.21 127.64 1.44 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.612 2.874 . . . . 10.0 113.031 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.89 127.5 24.59 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 123.349 2.699 . . . . 10.0 112.297 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.705 ' H ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -68.14 132.12 91.94 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.519 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.94 -20.58 45.38 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 123.445 2.763 . . . . 10.0 113.745 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -34.13 77.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.782 0.325 . . . . 10.0 111.244 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.557 HG22 ' HG ' ' A' ' 26' ' ' LEU . 24.1 m -128.37 -160.8 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.696 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' C' ' 50' ' ' HIS . 3.8 ptp180 -129.99 51.52 2.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 10.0 110.815 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -149.7 148.0 28.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.602 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' C' ' 84' ' ' GLU . 4.4 pp -72.01 154.27 41.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.909 0.385 . . . . 10.0 111.148 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.0 OUTLIER -92.03 162.42 14.38 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.756 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.2 tt0 -112.02 115.45 28.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.254 -0.276 . . . . 10.0 110.254 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.032 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.9 t70 -156.87 -76.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.865 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.18 -59.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.3 m0 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.359 -0.829 . . . . 10.0 109.857 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmm . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.59 0.233 . . . . 10.0 111.506 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.63 142.14 28.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.568 HG11 HD13 ' B' ' 57' ' ' LEU . 95.6 t -127.8 125.66 65.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.775 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.75 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 55.5 m-85 -113.77 112.35 23.28 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.615 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.62 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.57 158.04 41.08 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.785 0.326 . . . . 10.0 111.06 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.449 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 31.7 mtm -126.24 112.81 16.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.734 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' B' ' 75' ' ' VAL . 46.1 mm -84.32 105.69 13.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -100.85 102.35 13.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 32.3 ttp85 -92.38 65.33 4.51 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.036 -1.468 . . . . 10.0 107.036 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 65.11 -86.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.022 -0.99 . . . . 10.0 111.479 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -95.24 -21.65 18.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.665 0.246 . . . . 10.0 111.665 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -99.58 105.18 17.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.665 0.269 . . . . 10.0 111.684 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 26.4 m -103.18 121.39 42.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.716 0.293 . . . . 10.0 110.236 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.67 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.3 mt -111.08 117.95 56.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.434 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -77.39 113.09 14.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.62 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -106.26 108.27 19.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.325 0.583 . . . . 10.0 111.928 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 1.053 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 2.6 t70 -95.46 106.45 18.52 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.684 -1.228 . . . . 10.0 107.684 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -129.28 -165.85 1.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.548 -0.296 . . . . 10.0 111.286 -178.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -125.32 160.65 28.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.28 -21.87 66.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.91 0.386 . . . . 10.0 111.953 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -16.98 57.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.389 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.6 m -72.99 147.0 45.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.887 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.9 p -96.79 166.13 11.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.922 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.58 -35.17 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.184 0.516 . . . . 10.0 109.705 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -60.58 -37.55 81.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.994 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -65.07 -34.63 78.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.958 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.682 HD11 HD21 ' B' ' 57' ' ' LEU . 89.1 mt -59.93 -45.37 92.83 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.806 -0.442 . . . . 10.0 109.806 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -64.28 -34.03 77.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.539 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -67.26 -33.29 75.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.148 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.407 HD12 ' HA ' ' B' ' 27' ' ' LEU . 64.8 mt -72.14 -46.29 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 88.0 t -64.2 -31.64 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.234 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.7 tt0 -56.36 -43.11 78.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.973 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.26 -19.71 79.45 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 10.0 112.515 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 75.2 mt -87.69 -59.75 2.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 111.845 0.313 . . . . 10.0 111.845 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.6 mt -80.83 -12.67 59.39 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.086 0.402 . . . . 10.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 84.9 mttt 60.17 36.35 21.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.155 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 37' ' ' ARG . 27.3 mtt180 -127.65 144.82 52.5 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.731 -179.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.52 127.68 16.49 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.699 2.933 . . . . 10.0 113.856 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.771 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 52.7 Cg_endo -71.39 -19.76 28.44 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.886 2.391 . . . . 10.0 111.81 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.66 -28.85 68.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.691 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -94.28 0.23 55.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.32 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -84.93 129.03 34.87 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.241 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.516 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.9 mmt-85 -116.7 107.11 14.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.189 -0.459 . . . . 10.0 109.862 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.4 mt -89.63 113.73 25.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.554 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . 0.404 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 54.9 m-85 -110.8 113.59 26.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.125 0.488 . . . . 10.0 111.813 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.485 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 37.6 tttm -119.01 128.91 54.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 62.93 37.78 11.71 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.488 0.493 . . . . 10.0 110.947 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 64.36 21.43 12.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.218 -0.901 . . . . 10.0 112.027 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -136.73 155.65 49.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.8 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.7 tp -78.13 141.13 38.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.466 -0.333 . . . . 10.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 mt -84.89 151.82 24.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.076 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.522 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 30.9 t0 -88.72 118.57 28.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.281 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.15 -26.99 68.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 10.0 112.267 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.37 2.69 81.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.074 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 51.1 mttp -109.81 154.97 22.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.231 0.539 . . . . 10.0 111.731 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 36.5 p -86.79 172.21 10.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.501 -0.772 . . . . 10.0 109.59 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.682 HD21 HD11 ' B' ' 27' ' ' LEU . 54.2 mt -63.71 -37.63 88.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.701 0.286 . . . . 10.0 110.399 179.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.83 -33.74 87.83 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.893 -0.67 . . . . 10.0 112.182 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.57 -25.82 45.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.697 0.284 . . . . 10.0 111.525 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.9 m -89.41 0.96 56.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.18 64.31 1.66 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.714 -0.755 . . . . 10.0 113.096 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.485 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 24.5 m-85 -124.7 47.37 2.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.857 0.36 . . . . 10.0 110.175 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 79.1 p -68.34 164.02 21.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -17.39 63.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.765 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.84 -30.17 50.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.09 0.471 . . . . 10.0 110.239 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.94 -36.27 12.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.075 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.75 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -108.45 100.22 9.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 109.875 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.41 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 0.3 OUTLIER -115.04 157.0 44.55 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.21 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.87 -14.79 46.26 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.372 2.048 . . . . 10.0 111.33 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.498 ' H ' ' HG3' ' B' ' 70' ' ' GLN . 0.0 OUTLIER -106.78 0.86 24.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.622 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.497 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -164.51 90.29 1.04 Allowed Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.126 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.449 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -76.76 138.07 18.55 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.956 2.437 . . . . 10.0 111.449 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.96 122.88 16.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.666 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.03 122.6 25.16 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.569 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.445 ' HB ' HD13 ' B' ' 7' ' ' ILE . 45.3 t -125.6 129.24 72.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.37 140.85 19.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.785 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -119.86 105.46 11.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.049 0.452 . . . . 10.0 111.885 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.516 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.8 127.96 44.88 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -104.04 117.73 34.98 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.954 -0.298 . . . . 10.0 111.187 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -71.98 97.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.684 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.67 126.53 47.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.188 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.26 134.47 57.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.876 -0.602 . . . . 10.0 112.084 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 67.8 7.58 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.432 -0.804 . . . . 10.0 112.542 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 4.2 m -105.56 98.71 8.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.165 0.507 . . . . 10.0 110.325 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -66.92 -14.23 62.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.098 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -57.12 -32.17 66.07 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.998 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.48 67.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.79 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.7 mt -83.12 -5.25 59.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.521 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 27.2 m -105.28 -14.84 15.22 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.3 mt -104.23 6.29 10.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.155 0.502 . . . . 10.0 111.164 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.404 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 45.5 tt0 -104.52 107.24 57.36 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.173 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.618 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.5 Cg_exo -65.58 -10.66 27.22 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.049 2.5 . . . . 10.0 111.955 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -76.81 -20.68 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.912 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -119.14 -48.42 2.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.954 -0.567 . . . . 10.0 111.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.618 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 20.0 m -115.13 141.47 27.07 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.965 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.44 153.74 75.8 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.526 2.151 . . . . 10.0 111.929 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.19 141.46 94.44 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.046 2.497 . . . . 10.0 112.633 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -72.71 117.61 14.63 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.187 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 31.6 tp -146.32 124.23 6.18 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.486 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.415 ' HG2' ' HE1' ' C' ' 50' ' ' HIS . 22.7 Cg_exo -66.64 136.27 41.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.751 2.301 . . . . 10.0 112.13 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -66.83 -30.91 71.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.397 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.7 m -70.91 -16.04 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.496 0.665 . . . . 10.0 110.243 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.723 ' HA ' HE22 ' B' ' 106' ' ' GLN . 88.1 mmm -124.27 54.49 1.35 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.318 -0.856 . . . . 10.0 108.99 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.529 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 39.9 tttm -132.23 -49.5 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.329 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.529 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 10.3 Cg_exo -73.02 65.57 4.15 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 122.309 2.006 . . . . 10.0 111.958 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.723 HE22 ' HA ' ' B' ' 103' ' ' MET . 1.5 mt-30 -134.72 174.97 9.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.902 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -90.87 176.96 6.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.845 0.355 . . . . 10.0 111.201 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -102.93 135.62 44.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.123 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -88.82 -143.64 9.58 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.046 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.84 -38.47 11.22 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.185 0.516 . . . . 10.0 110.722 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.679 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.3 m -76.75 159.61 30.0 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.761 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . 0.497 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.16 121.14 14.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 179.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 72.33 16.92 4.97 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.915 0.759 . . . . 10.0 111.903 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.679 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 27.0 tt0 -71.53 119.98 16.45 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.822 0.344 . . . . 10.0 110.078 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.88 122.48 33.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.834 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.437 ' HB1' HE22 ' B' ' 118' ' ' GLN . . . -106.9 103.28 12.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.883 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.515 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.5 t -90.46 101.38 12.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.52 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.437 HE22 ' HB1' ' B' ' 116' ' ' ALA . 1.7 mp0 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.78 0.324 . . . . 10.0 111.363 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.481 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.2 ttpt -110.87 117.59 33.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.707 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.53 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 31.7 mt -92.61 123.56 36.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.081 -0.509 . . . . 10.0 109.839 179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 mt -107.57 116.98 52.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.8 p -89.04 177.76 6.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.494 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 13.7 m -76.99 2.85 13.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.862 0.363 . . . . 10.0 111.658 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -102.14 3.67 38.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 10.0 110.356 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.56 12.83 84.13 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.649 -0.786 . . . . 10.0 111.398 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.6 133.94 33.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.657 0.265 . . . . 10.0 110.324 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.481 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 21.5 mt-10 -107.18 126.66 52.68 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.071 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.66 108.57 16.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.562 -0.29 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.67 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 9.4 mm -89.79 118.68 35.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.841 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 23.6 t -105.95 135.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 1.053 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 53.7 tttt -59.71 132.04 52.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 110.135 -0.321 . . . . 10.0 110.135 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 11.2 tpt180 -52.06 -37.04 52.39 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.447 0.467 . . . . 10.0 111.21 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.502 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 58.0 tt0 -54.53 -43.22 71.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.537 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -85.27 -33.36 22.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.035 0.445 . . . . 10.0 110.742 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.47 91.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.521 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 89.2 mt -58.39 -48.18 81.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.966 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -39.54 93.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.468 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -64.88 -36.7 85.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.8 -6.7 82.48 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.657 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 19.8 m -91.02 -22.1 20.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.307 0.575 . . . . 10.0 109.71 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -76.6 152.44 5.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.651 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -70.62 80.53 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.175 0.512 . . . . 10.0 110.529 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -97.36 178.15 5.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.678 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 94.3 mmm -78.5 35.39 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.981 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.57 -26.54 66.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.353 0.597 . . . . 10.0 109.606 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 4.3 m -95.54 17.65 14.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.243 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.85 -61.99 3.8 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.573 -0.739 . . . . 10.0 112.673 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.33 -174.8 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.514 2.143 . . . . 10.0 111.901 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.04 -79.21 0.15 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.986 -0.626 . . . . 10.0 112.519 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -122.24 127.71 50.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -88.65 85.17 6.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.317 0.579 . . . . 10.0 111.076 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.11 155.39 32.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.34 -25.43 49.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.996 0.739 . . . . 10.0 112.996 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.11 -39.45 90.02 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.616 -0.512 . . . . 10.0 109.616 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.532 ' O ' HG22 ' C' ' 42' ' ' VAL . 14.9 tp10 -88.84 -13.98 38.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.267 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 6.8 m -78.27 -40.26 37.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 10.0 110.191 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -75.66 -44.43 42.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.179 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -128.63 103.62 7.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.321 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.532 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.9 t -94.8 123.64 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.885 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -101.35 121.03 41.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.877 0.37 . . . . 10.0 110.892 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.562 ' HB3' HD12 ' C' ' 47' ' ' ILE . 95.3 m-85 -101.61 117.31 34.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.956 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 6.4 mmt180 -92.16 132.79 36.35 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.374 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 1.4 mp0 75.11 3.81 4.15 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.998 0.811 . . . . 10.0 112.279 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.562 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.1 mt -106.62 109.02 62.85 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.984 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.57 157.68 59.5 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.152 2.568 . . . . 10.0 112.127 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.9 p -64.78 -39.36 93.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.498 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . 0.426 ' HB2' ' HD3' ' A' ' 30' ' ' ARG . 6.7 m80 -52.24 -59.07 4.83 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.818 0.673 . . . . 10.0 112.818 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.467 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.7 m -64.93 -35.66 75.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 10.0 111.397 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 -33.97 77.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.804 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 26.1 m -61.92 -43.06 99.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.893 0.378 . . . . 10.0 110.547 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -66.43 -35.6 80.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.311 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' C' ' 51' ' ' VAL . 88.1 t -63.36 -47.55 91.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.09 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 36.0 m -60.29 -42.92 96.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.854 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.3 mtm -67.26 -37.27 83.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.611 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.4 t80 -65.74 -41.95 91.56 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.427 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.409 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.8 m-85 -64.72 -45.7 85.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.104 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 42.9 m -58.69 -42.35 88.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.301 0.572 . . . . 10.0 109.665 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -64.75 -43.7 92.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.143 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -62.79 -40.75 98.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.098 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.409 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.2 t -60.07 -50.48 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.1 mmt180 -68.89 -37.85 79.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.338 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 69.0 t80 -58.2 -48.24 80.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.064 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.13 7.05 23.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.67 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.85 -46.93 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.177 -0.327 . . . . 10.0 111.57 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 6.3 m -146.15 -34.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.555 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.9 m -80.74 42.5 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.296 0.48 . . . . 10.0 112.296 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.06 -7.13 57.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.241 0.543 . . . . 10.0 110.066 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -78.76 -21.54 47.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.636 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 39.7 pt -95.96 163.8 20.17 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.194 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.636 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 80.8 Cg_endo -76.99 -177.31 3.72 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.304 2.003 . . . . 10.0 112.726 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.96 169.9 13.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.009 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -54.16 128.98 58.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.556 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -50.76 129.49 27.5 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.126 2.551 . . . . 10.0 112.834 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 pt -81.65 36.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.568 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -80.08 -59.71 0.53 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.395 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 72.1 Cg_endo -79.74 119.67 4.09 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.764 1.643 . . . . 10.0 110.505 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.35 12.32 1.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 38.4 mm -78.9 75.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.408 0.623 . . . . 10.0 109.952 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -138.92 -43.21 0.47 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.119 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.413 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 13.4 tp -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.644 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.591 ' HA ' HD23 ' A' ' 32' ' ' LEU . 23.9 mp0 -60.5 -37.29 80.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.325 -0.852 . . . . 10.0 109.47 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 8' ' ' LEU . 60.3 mt -79.49 -36.64 38.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.731 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.77 -31.75 73.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.525 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.9 ttp -58.98 -25.2 63.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.915 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.15 -35.49 73.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.05 -55.2 0.56 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.293 0.849 . . . . 10.0 113.293 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -81.97 36.17 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.117 0.484 . . . . 10.0 111.14 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.695 -0.669 . . . . 10.0 109.574 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.637 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.195 -0.362 . . . . 10.0 112.195 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.448 ' CB ' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -68.0 -57.82 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.214 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.828 HD21 ' HB3' ' C' ' 85' ' ' LEU . 23.5 tp -63.12 -27.85 69.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.933 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -55.51 -35.09 65.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.265 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -95.36 -37.33 11.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.329 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 95.0 mt -63.07 -36.85 84.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.385 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.8 88.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.349 . . . . 10.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.3 tp -68.6 -30.03 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.279 0.561 . . . . 10.0 109.547 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.43 -8.89 59.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.52 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.15 -35.69 11.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.171 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.669 ' HA ' HG22 ' C' ' 77' ' ' ILE . 3.7 tp -163.56 122.38 2.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.172 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.0 mt -82.55 92.65 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 79.5 tttt -104.45 107.21 57.16 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.44 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -95.29 52.62 0.2 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.325 2.684 . . . . 10.0 111.173 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 69.1 mttt -108.87 174.82 5.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.874 -179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -80.47 143.02 33.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.739 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -100.24 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.074 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.094 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER -120.88 136.24 25.38 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.416 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.7 Cg_exo -34.5 133.49 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.147 3.231 . . . . 10.0 113.624 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.695 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 29.2 Cg_endo -62.98 138.23 66.78 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.0 2.467 . . . . 10.0 112.442 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -71.48 125.76 91.76 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.376 179.38 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -61.13 -22.33 74.35 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.224 2.616 . . . . 10.0 113.198 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -35.89 82.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.051 0.453 . . . . 10.0 111.074 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 t -120.07 -132.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.86 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.0 ptp180 -158.98 52.66 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.112 0.482 . . . . 10.0 111.258 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 14.9 tttm -149.57 148.44 29.36 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.695 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.65 148.9 44.35 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.83 0.347 . . . . 10.0 110.681 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -91.4 172.93 8.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.075 -179.108 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.457 ' H ' HG22 ' A' ' 33' ' ' THR . 6.7 mt-10 -117.16 113.59 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.399 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.094 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.4 t70 -156.57 -81.64 0.07 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 -62.62 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.9 m0 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.54 179.654 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 mmm . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.949 0.404 . . . . 10.0 110.801 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.77 122.95 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.922 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.415 HG11 HD13 ' B' ' 57' ' ' LEU . 93.3 t -123.65 116.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.107 0.48 . . . . 10.0 111.095 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.47 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 44.7 m-85 -105.08 110.97 23.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.551 -0.75 . . . . 10.0 109.473 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.67 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -124.56 154.63 40.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.991 0.425 . . . . 10.0 111.646 -179.289 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.596 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 53.9 mtm -122.77 104.87 9.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.334 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.496 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.4 mm -78.2 107.25 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.912 -0.773 . . . . 10.0 108.912 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -109.95 104.4 13.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.866 0.691 . . . . 10.0 112.866 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.456 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 27.8 ttp85 -89.03 67.43 8.1 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.595 -1.261 . . . . 10.0 107.595 177.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.549 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.1 t-160 67.77 -76.69 0.05 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.174 -0.921 . . . . 10.0 111.485 -178.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.407 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 72.3 mmtt -110.01 -9.35 14.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.483 -0.326 . . . . 10.0 111.382 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.8 m -105.2 99.59 9.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.062 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.2 m -101.17 125.53 47.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.923 0.392 . . . . 10.0 111.019 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 40.2 mt -121.52 121.85 65.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.313 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . 0.47 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 62.3 t80 -79.6 121.69 25.58 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.67 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.0 m -114.7 119.82 38.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.089 0.471 . . . . 10.0 111.452 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.678 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.9 t70 -103.31 103.68 13.72 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.207 -1.034 . . . . 10.0 108.207 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . 0.466 ' O ' ' HD3' ' B' ' 19' ' ' LYS . . . -130.64 -166.66 1.72 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.653 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.466 ' HD3' ' O ' ' B' ' 18' ' ' ALA . 20.7 mmtt -128.88 165.5 20.92 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.754 -0.462 . . . . 10.0 109.754 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.401 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 16.9 mp0 -61.52 -28.46 69.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.649 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 m -69.13 -21.49 64.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.85 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 2.3 m -73.75 145.23 45.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.743 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.5 p -94.34 162.97 13.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.761 0.315 . . . . 10.0 111.033 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.517 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 97.4 t -64.89 -34.03 67.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.133 0.492 . . . . 10.0 109.992 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -62.56 -34.99 78.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.406 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -68.24 -33.37 74.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.906 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.77 HD11 HD21 ' B' ' 57' ' ' LEU . 87.1 mt -62.15 -43.71 98.24 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.735 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.1 mttt -62.23 -33.81 75.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.237 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtp180 -66.2 -40.44 90.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.512 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.61 -46.8 91.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.835 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.98 -36.84 77.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.673 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.628 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.4 tm-20 -56.5 -43.39 79.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.34 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.88 -18.02 78.74 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -94.08 -57.29 4.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.774 0.321 . . . . 10.0 111.528 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.588 HD21 HG21 ' B' ' 12' ' ' THR . 22.1 mt -76.87 -14.19 59.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.3 mttt 64.75 31.61 11.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.373 0.606 . . . . 10.0 110.994 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.402 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 62.8 mtt-85 -123.42 135.08 25.67 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.856 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 74.7 Cg_exo -53.07 138.82 62.61 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 123.384 2.723 . . . . 10.0 113.028 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.735 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 13.9 Cg_exo -70.82 -12.53 31.03 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.831 2.354 . . . . 10.0 111.19 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.15 -45.66 75.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.204 -0.907 . . . . 10.0 112.134 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -99.83 16.76 22.68 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -88.04 123.45 32.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.816 0.341 . . . . 10.0 110.849 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' B' ' 43' ' ' ARG . 39.7 mmt-85 -116.1 111.86 20.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.11 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -96.01 120.39 36.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.402 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -113.75 127.8 56.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.496 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.0 tttm -135.49 137.26 41.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 48' ' ' ASP . 4.7 m-20 62.44 25.26 15.06 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.347 0.405 . . . . 10.0 110.379 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 47' ' ' ASP . 78.6 m-20 75.18 4.32 4.16 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.404 -0.816 . . . . 10.0 112.239 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -119.54 163.11 17.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.069 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.0 tp -79.97 141.14 36.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.544 0.211 . . . . 10.0 110.689 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -80.37 155.58 27.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.318 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -98.92 115.37 28.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.859 0.361 . . . . 10.0 111.199 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.517 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 78.4 m-20 -60.33 -29.37 68.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.639 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 3.84 75.88 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.003 -0.617 . . . . 10.0 113.485 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -118.02 163.53 16.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.066 0.46 . . . . 10.0 111.017 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.5 p -92.25 170.44 9.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.896 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.77 HD21 HD11 ' B' ' 27' ' ' LEU . 34.7 mt -62.26 -41.91 98.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.904 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.73 -40.58 95.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.09 -0.576 . . . . 10.0 112.512 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -72.27 -21.16 61.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 10.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 70.2 m -89.47 3.17 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.009 0.433 . . . . 10.0 111.646 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.61 2.72 63.1 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.724 -0.751 . . . . 10.0 113.293 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.496 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 57.5 m-85 -75.77 96.85 3.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.05 0.425 . . . . 10.0 110.171 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 55.1 p -114.94 164.55 13.98 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 20.0 m -72.52 -2.45 19.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.304 0.573 . . . . 10.0 110.476 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -90.17 -49.42 6.57 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.642 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -35.02 55.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.043 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.11 103.69 12.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.526 ' HB3' ' HG3' ' B' ' 70' ' ' GLN . 16.3 mtm180 -119.31 163.07 28.81 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.731 -178.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.409 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 32.8 Cg_endo -66.78 -14.88 45.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.043 1.829 . . . . 10.0 110.531 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -103.76 -1.62 27.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.169 -0.923 . . . . 10.0 110.104 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.729 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.63 84.17 1.35 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.438 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.9 Cg_exo -76.87 136.41 16.68 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.855 2.37 . . . . 10.0 111.837 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 122.19 17.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.418 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -80.81 124.69 29.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.948 0.404 . . . . 10.0 111.448 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.496 ' HB ' HD13 ' B' ' 7' ' ' ILE . 39.6 t -117.87 125.92 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.95 126.85 7.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.768 -0.73 . . . . 10.0 111.91 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.54 111.17 22.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.719 0.295 . . . . 10.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -107.29 128.91 54.87 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.669 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -105.04 116.58 32.19 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.229 -0.285 . . . . 10.0 110.229 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -76.75 85.5 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.581 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -96.72 131.42 43.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.77 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.79 140.22 58.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.28 7.4 4.87 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.982 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.8 m -117.87 104.59 11.08 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -76.68 0.36 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 10.0 112.061 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.1 tt0 -57.12 -32.22 66.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.04 0.448 . . . . 10.0 110.657 179.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.23 -26.24 67.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.747 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.8 mt -75.66 -26.29 57.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.831 0.348 . . . . 10.0 111.005 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 22.4 m -83.61 -32.32 25.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' B' ' 10' ' ' HIS . 17.6 mt -81.78 -27.09 9.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.388 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -70.01 110.51 6.8 Favored Pre-proline 0 C--O 1.234 0.284 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.314 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.617 ' HA ' ' O ' ' B' ' 95' ' ' SER . 15.4 Cg_exo -69.88 -8.89 24.74 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.544 2.829 . . . . 10.0 112.531 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.842 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.9 m -99.0 -44.68 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.236 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.617 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 13.0 m -107.48 144.35 29.05 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.067 -179.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 159.84 47.42 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.595 2.197 . . . . 10.0 111.576 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.22 128.07 21.79 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.559 2.172 . . . . 10.0 111.473 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.76 106.84 3.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.101 0.476 . . . . 10.0 111.668 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 35.1 tp -129.78 120.71 19.65 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.188 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -51.43 120.31 6.73 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.755 2.303 . . . . 10.0 111.761 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.01 -33.7 71.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.427 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.14 -15.32 18.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.808 0.337 . . . . 10.0 111.347 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 67.5 mmm -115.22 21.28 14.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.412 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.447 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 50.3 tttm -96.41 -51.08 0.23 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 113.565 0.95 . . . . 10.0 113.565 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.447 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 56.5 Cg_endo -71.62 82.87 1.12 Allowed 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.145 1.897 . . . . 10.0 112.743 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -161.03 -171.69 3.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.689 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.49 ' HB2' HE22 ' B' ' 118' ' ' GLN . 5.5 t0 -104.83 174.99 5.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.916 0.389 . . . . 10.0 111.215 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -100.99 157.12 16.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.49 -129.99 5.1 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.678 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 10.5 m -110.93 -31.09 7.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.093 0.473 . . . . 10.0 110.024 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.729 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 51.0 m -86.53 170.76 11.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.932 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.47 134.04 36.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.1 t30 70.59 7.38 6.19 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.555 0.535 . . . . 10.0 111.032 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 50.7 tt0 -84.9 121.06 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -108.87 151.78 25.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.741 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -128.81 103.81 7.27 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.477 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.586 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.1 t -67.7 134.29 30.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' B' ' 107' ' ' ASP . 12.6 mp0 . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.183 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.061 0.457 . . . . 10.0 110.841 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -105.25 115.86 30.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.452 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.474 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 25.2 mt -90.63 133.29 35.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.882 -0.784 . . . . 10.0 108.882 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 13.3 mt -118.6 113.63 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.762 -0.199 . . . . 10.0 110.691 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.15 161.33 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -20.98 64.78 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.256 0.465 . . . . 10.0 112.256 -179.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -74.15 -10.48 59.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.704 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.16 39.25 8.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.595 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -111.73 140.95 45.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.719 0.295 . . . . 10.0 110.265 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.611 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.3 mt-10 -99.86 128.64 45.94 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.495 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 65.6 m-85 -127.69 96.73 4.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.95 0.405 . . . . 10.0 110.531 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.55 116.48 34.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.001 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.5 t -100.54 141.5 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.823 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.678 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 75.3 tttt -55.98 130.09 42.44 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.169 0.293 . . . . 10.0 110.237 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.649 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 63.4 ttt180 -54.6 -34.8 62.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.702 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -56.49 -46.85 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.154 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -74.65 -31.95 62.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.15 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.44 68.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.909 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 55.4 mt -58.75 -56.82 17.3 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.151 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -65.9 -31.39 72.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.716 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 43.9 m -65.32 -33.27 75.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 10.0 109.922 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.17 -12.82 82.8 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.128 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.09 -12.5 57.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.389 0.614 . . . . 10.0 110.029 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 45.5 mt -90.71 146.69 5.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.813 -0.81 . . . . 10.0 108.813 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.33 76.52 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.438 0.637 . . . . 10.0 111.102 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' SER . . . -85.55 -174.21 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.094 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.637 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.7 mmm -79.12 37.36 0.31 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mp -69.8 -32.64 71.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.16 13.96 19.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.17 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . 0.428 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -75.97 -56.3 4.5 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.633 -0.712 . . . . 10.0 113.109 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 42.0 Cg_endo -66.73 179.63 2.09 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.661 2.241 . . . . 10.0 112.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.28 -46.77 14.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.698 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -141.76 104.68 4.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.766 0.317 . . . . 10.0 110.606 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -87.02 89.61 8.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.98 0.419 . . . . 10.0 110.602 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.98 174.91 8.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.569 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.23 -25.85 68.25 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.673 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -58.98 -43.28 91.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.054 0.454 . . . . 10.0 109.779 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.7 mp0 -75.34 -18.49 59.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.822 179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.9 m -78.57 -30.32 46.75 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -81.68 -50.88 8.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.661 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.18 107.13 9.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.8 t -94.55 103.77 15.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.455 -179.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -89.39 122.68 32.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.036 0.446 . . . . 10.0 111.053 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.702 ' HB3' HD12 ' C' ' 47' ' ' ILE . 86.5 m-85 -103.62 144.03 31.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.632 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -113.65 132.52 55.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.507 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 61.02 28.94 18.68 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.694 0.621 . . . . 10.0 112.663 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.702 HD12 ' HB3' ' C' ' 44' ' ' PHE . 83.7 mt -121.82 103.08 40.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.587 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.447 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 48.7 Cg_exo -57.5 140.28 92.77 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.092 2.528 . . . . 10.0 113.097 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -59.61 -36.1 75.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.278 -0.873 . . . . 10.0 111.093 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -51.22 70.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.43 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.1 m -70.85 -29.21 36.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.95 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 tp -66.37 -36.91 84.08 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -61.98 -33.94 75.24 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.139 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 13.4 tptp -65.42 -39.93 92.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.571 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -67.24 -46.52 83.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.933 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 76.5 m -58.21 -42.87 87.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.428 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.2 mtm -64.9 -39.52 93.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.815 0.34 . . . . 10.0 110.884 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -67.48 -39.06 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.379 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -64.22 -46.5 83.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.06 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 31.5 m -59.19 -42.1 90.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.374 0.607 . . . . 10.0 109.782 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.409 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 14.5 t80 -66.56 -43.48 84.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.39 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -63.62 -38.77 92.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.492 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.35 -47.44 92.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.986 0.422 . . . . 10.0 110.253 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.867 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 16.3 t80 -58.21 -45.08 88.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.639 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -87.31 21.54 2.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.202 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -131.4 -47.82 0.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.085 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.22 -39.87 0.4 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.011 0.375 . . . . 10.0 112.011 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.57 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -76.53 39.67 0.21 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.04 -11.03 45.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.126 0.488 . . . . 10.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -92.57 4.82 52.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.42 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 pt -118.25 156.38 50.76 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.186 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.69 159.72 16.43 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.2 2.6 . . . . 10.0 112.999 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 13.4 tp10 -69.09 171.08 8.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.215 -0.902 . . . . 10.0 109.597 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.411 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 36.4 t80 -47.91 130.76 11.76 Favored Pre-proline 0 C--O 1.233 0.19 0 O-C-N 123.291 0.369 . . . . 10.0 110.923 179.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -53.09 111.8 0.76 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.078 2.519 . . . . 10.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.1 pt -76.75 61.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.371 0.605 . . . . 10.0 111.18 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -114.67 -53.3 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.587 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 24.8 Cg_exo -64.11 119.72 6.85 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.948 1.765 . . . . 10.0 111.486 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.78 -14.58 46.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.404 0.52 . . . . 10.0 112.404 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -79.62 98.67 3.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.046 0.451 . . . . 10.0 110.471 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.08 -43.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.648 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.466 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.9 tp -67.18 -24.28 65.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.551 ' HA ' HD23 ' A' ' 32' ' ' LEU . 32.9 mp0 -62.88 -29.65 70.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.985 -1.007 . . . . 10.0 109.779 178.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.828 ' HB3' HD21 ' A' ' 8' ' ' LEU . 50.1 mt -77.01 -32.45 57.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.452 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -21.41 63.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.984 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.0 ttp -66.1 -18.74 65.54 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.663 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.95 -33.18 75.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.776 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.72 -61.28 0.37 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.985 0.803 . . . . 10.0 112.933 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -82.65 45.95 1.03 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.903 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.598 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.7 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.097 -0.705 . . . . 10.0 109.097 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 112.145 -0.382 . . . . 10.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.443 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.23 -55.9 18.39 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -60.37 -30.47 69.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -178.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.69 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 31.1 mt-30 -58.12 -32.68 68.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 10.0 111.042 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -96.95 -40.8 8.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.001 0.429 . . . . 10.0 110.426 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.519 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.9 mt -60.27 -42.7 95.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.16 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.23 64.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.727 0.298 . . . . 10.0 111.082 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.2 tp -63.83 -40.06 95.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.023 0.44 . . . . 10.0 110.422 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -14.15 59.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.955 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.9 -24.16 20.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.776 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 2.7 tp -164.54 110.37 1.0 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 10.0 111.835 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.2 mt -84.31 88.02 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.625 ' HB3' HD22 ' C' ' 83' ' ' LEU . 83.7 tttt -96.1 106.65 29.83 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.836 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 3.4 Cg_endo -88.23 60.32 3.02 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.546 2.831 . . . . 10.0 112.092 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -126.91 167.28 16.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -79.32 151.97 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.24 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.631 HD11 HD23 ' C' ' 83' ' ' LEU . 48.2 mm -113.47 100.02 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.906 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 36.6 tttp -107.63 138.26 19.94 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.41 133.12 0.16 Allowed 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.756 2.97 . . . . 10.0 113.422 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.916 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.0 Cg_endo -53.42 151.85 22.26 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.898 3.065 . . . . 10.0 114.281 -178.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mp -81.07 122.36 81.59 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.641 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -59.19 -26.21 80.91 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.274 2.649 . . . . 10.0 113.091 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -35.96 78.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.62 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.431 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 4.3 m -118.59 -145.53 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.763 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 2.5 ptp180 -143.29 53.8 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.381 0.61 . . . . 10.0 110.634 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.6 tttm -150.38 150.28 31.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.026 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.916 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -76.04 156.12 34.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 10.0 110.806 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.58 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -90.05 152.11 21.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.668 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -107.35 106.16 16.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.861 0.362 . . . . 10.0 110.509 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.906 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 t70 -164.36 -72.58 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.114 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.28 -69.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.143 -0.932 . . . . 10.0 109.4 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.855 0.359 . . . . 10.0 110.508 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.12 136.15 39.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.824 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.41 HG11 HD13 ' B' ' 57' ' ' LEU . 52.6 t -124.97 124.46 67.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.165 0.507 . . . . 10.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.46 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.9 m-85 -113.74 111.7 22.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.735 179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.738 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -126.32 156.15 40.88 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.962 0.411 . . . . 10.0 111.66 -179.779 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.651 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 67.3 mtm -124.2 107.77 11.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.313 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.55 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -80.56 109.45 15.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -105.74 105.89 16.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.162 0.431 . . . . 10.0 112.162 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.513 ' HB2' HD23 ' B' ' 77' ' ' LEU . 10.0 ttp85 -104.6 95.42 5.9 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 177.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 66.13 -88.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.622 0.577 . . . . 10.0 109.691 -178.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -129.16 11.4 5.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.321 0.581 . . . . 10.0 110.434 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 4.2 m -106.45 99.08 8.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.293 178.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' B' ' 7' ' ' ILE . 30.9 m -100.68 126.29 47.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.903 0.382 . . . . 10.0 111.083 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.626 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.7 mt -114.66 119.64 62.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.581 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -76.91 117.42 18.5 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.311 -0.625 . . . . 10.0 109.311 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.738 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -112.23 109.82 19.72 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.815 0.672 . . . . 10.0 112.815 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.589 ' HB3' ' CD ' ' C' ' 14' ' ' LYS . 3.7 t70 -97.05 106.87 19.29 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.322 -1.362 . . . . 10.0 107.322 177.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.31 -168.86 2.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.905 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -124.89 161.02 27.48 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' B' ' 56' ' ' THR . 49.6 mt-10 -59.67 -27.1 66.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 10.0 111.74 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.56 -17.79 63.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.695 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.9 m -78.39 134.7 37.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.878 0.371 . . . . 10.0 110.781 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.1 p -85.13 167.26 15.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.197 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.85 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 93.3 t -63.39 -35.82 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 10.0 110.761 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 55.8 t80 -65.33 -33.34 75.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.638 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -65.74 -30.03 70.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.83 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.948 HD11 HD21 ' B' ' 57' ' ' LEU . 64.0 mt -66.8 -42.78 85.39 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.804 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.8 mttt -62.23 -31.57 72.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.212 -0.904 . . . . 10.0 110.526 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -64.59 -41.3 96.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.769 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.69 -43.4 93.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.96 -35.52 73.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.154 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.545 ' HB2' ' HG3' ' B' ' 39' ' ' PRO . 24.4 tt0 -60.97 -41.11 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.02 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.93 -20.88 79.71 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.04 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.9 mt -93.77 -49.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 23.8 mt -84.58 -14.84 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.334 0.494 . . . . 10.0 112.334 -178.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 63.74 32.02 13.92 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.12 0.486 . . . . 10.0 111.696 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -126.35 146.27 55.72 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.866 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.527 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 51.0 Cg_exo -56.71 133.01 55.28 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.418 2.745 . . . . 10.0 113.554 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.804 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 17.2 Cg_exo -70.3 -17.35 35.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.539 2.826 . . . . 10.0 112.165 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -65.51 -31.57 72.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.572 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.478 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 31.8 mm-40 -90.94 -1.72 57.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.644 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -89.28 126.34 35.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.37 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.511 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 21.9 mmt180 -116.41 113.63 23.13 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 48.4 mt -92.31 114.76 27.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.859 0.361 . . . . 10.0 111.18 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -110.65 115.75 30.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.795 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.613 ' HB3' HD21 ' B' ' 51' ' ' LEU . 13.4 tmtt? -129.09 135.96 49.6 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.259 -1.015 . . . . 10.0 108.259 179.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 65.61 32.67 9.06 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.48 0.488 . . . . 10.0 110.627 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.73 13.9 9.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.523 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -135.01 165.9 24.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.729 0.299 . . . . 10.0 110.73 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 tp -82.58 140.43 33.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.583 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.613 HD21 ' HB3' ' B' ' 46' ' ' LYS . 94.3 mt -87.87 146.25 25.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -88.43 113.76 24.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.64 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.85 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 90.4 m-20 -56.96 -29.68 63.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.125 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -76.49 -6.2 83.8 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.592 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -108.77 161.47 15.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.006 0.403 . . . . 10.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -87.4 169.4 12.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.5 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.948 HD21 HD11 ' B' ' 27' ' ' LEU . 51.5 mt -60.4 -43.5 96.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.189 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -55.27 -45.32 83.33 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.132 -0.556 . . . . 10.0 112.741 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -66.08 -28.93 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.111 0.412 . . . . 10.0 112.111 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . 0.442 ' HB3' HD22 ' B' ' 51' ' ' LEU . 56.4 m -83.79 11.14 7.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 10.0 112.101 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.87 49.12 7.27 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.763 -0.732 . . . . 10.0 112.777 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 36.6 m-85 -118.48 57.18 0.86 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.169 0.509 . . . . 10.0 110.317 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 14.3 p -76.71 161.6 28.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.728 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.2 p -64.55 -20.04 65.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.489 . . . . 10.0 111.952 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -78.32 -26.98 47.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.778 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -46.04 9.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.065 0.46 . . . . 10.0 109.869 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.46 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -104.1 105.49 15.68 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.54 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.458 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 68.1 mtt180 -116.39 161.13 33.15 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.222 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.584 ' HB3' ' HG3' ' C' ' 64' ' ' ARG . 27.5 Cg_endo -64.58 -19.07 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.219 1.946 . . . . 10.0 110.602 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.57 6.35 34.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.023 -0.989 . . . . 10.0 110.471 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.533 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -167.52 85.6 0.78 Allowed Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.925 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.651 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.7 Cg_exo -77.93 147.63 24.29 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.916 2.411 . . . . 10.0 111.669 179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.76 117.79 22.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.09 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 130.39 39.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.031 0.443 . . . . 10.0 111.622 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.55 ' HB ' HD13 ' B' ' 7' ' ' ILE . 43.9 t -124.36 132.41 71.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.05 129.37 9.03 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.846 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.513 HD23 ' HB2' ' B' ' 9' ' ' ARG . 39.3 tp -110.35 102.14 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.981 0.42 . . . . 10.0 111.962 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.511 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.12 132.61 37.1 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.372 -0.973 . . . . 10.0 108.372 178.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.478 ' CE1' ' HB2' ' B' ' 41' ' ' GLU . 52.1 t80 -117.07 119.1 34.22 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.848 -0.341 . . . . 10.0 111.398 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -70.76 117.52 12.38 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.997 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -131.23 149.96 52.35 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.395 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -76.58 126.13 30.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.665 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.87 -35.95 0.32 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.77 0.669 . . . . 10.0 112.567 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 0.2 OUTLIER -74.8 94.63 2.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.869 0.366 . . . . 10.0 110.199 179.185 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -79.24 16.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.909 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.47 ' O ' HG13 ' B' ' 90' ' ' ILE . 34.5 tt0 -61.33 -25.81 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.696 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.48 67.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.699 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.37 -41.62 98.77 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -79.19 -7.85 58.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.47 HG13 ' O ' ' B' ' 86' ' ' GLU . 8.0 mt -106.25 -0.52 9.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.481 0.658 . . . . 10.0 110.035 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.84 106.71 45.59 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.599 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.4 Cg_exo -65.83 -12.27 34.52 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.164 2.576 . . . . 10.0 112.146 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -76.6 -25.17 53.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.619 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -116.48 -32.77 5.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.599 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.0 m -125.03 146.97 55.36 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.483 0.183 . . . . 10.0 110.971 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.07 153.57 57.45 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 122.413 2.075 . . . . 10.0 111.539 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.61 133.67 40.69 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.715 2.276 . . . . 10.0 112.466 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.62 123.8 24.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.436 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.481 HD12 ' HD2' ' B' ' 100' ' ' PRO . 22.9 tp -147.25 128.76 7.31 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.408 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.481 ' HD2' HD12 ' B' ' 99' ' ' LEU . 10.9 Cg_endo -55.64 124.14 15.56 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.702 2.268 . . . . 10.0 111.564 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.86 -28.68 69.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.29 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.0 m -68.96 -12.49 16.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.147 0.499 . . . . 10.0 110.811 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.467 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 81.4 mmm -120.89 22.34 11.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.773 -0.648 . . . . 10.0 109.734 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -91.48 -51.18 0.31 Allowed Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.5 68.41 6.16 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.349 2.032 . . . . 10.0 112.244 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.467 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 61.4 mt-30 -132.48 -177.71 4.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.37 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' B' ' 118' ' ' GLN . 2.4 t0 -96.81 169.46 9.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.515 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 135.02 37.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.74 -147.67 7.94 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.972 -0.632 . . . . 10.0 113.372 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -99.27 -26.88 14.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.934 0.397 . . . . 10.0 110.89 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.437 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 21.0 m -91.41 163.92 14.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.269 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . 0.533 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.45 125.36 25.88 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.676 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.3 t30 70.0 16.01 7.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.508 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 3.1 tt0 -81.3 135.35 35.7 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.98 138.4 52.2 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.098 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.53 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -116.54 116.31 27.38 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.616 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.557 ' H ' HD11 ' C' ' 81' ' ' ILE . 1.7 t -77.86 143.45 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.151 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.473 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 24.8 mp0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.731 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.983 0.421 . . . . 10.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.706 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 37.0 ttpt -115.12 128.37 56.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.132 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.665 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 34.2 mt -96.37 125.11 40.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.842 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -102.02 117.41 47.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.637 0.256 . . . . 10.0 110.597 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -86.86 161.33 18.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.837 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.47 -24.67 67.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.316 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.31 8.66 8.6 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.694 0.283 . . . . 10.0 111.176 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.05 43.82 25.47 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 110.774 -0.93 . . . . 10.0 110.774 -179.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . 0.415 ' HE1' ' OG1' ' B' ' 13' ' ' THR . 11.5 t-80 -113.53 141.48 47.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.264 . . . . 10.0 110.451 -179.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.706 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 37.2 mt-10 -112.27 131.43 55.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.236 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' C' ' 2' ' ' LYS . 38.5 m-85 -124.1 104.73 9.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.652 179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.626 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 8.9 mm -87.16 115.08 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -101.13 129.39 52.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 110.092 -0.336 . . . . 10.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.589 ' CD ' ' HB3' ' B' ' 17' ' ' ASP . 77.3 tttt -59.47 128.33 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.613 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 44.6 ttt180 -50.74 -35.96 34.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.47 0.545 . . . . 10.0 112.47 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -50.45 -46.67 56.78 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.333 0.396 . . . . 10.0 111.735 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -85.83 -27.71 24.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.164 0.507 . . . . 10.0 110.717 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . 0.426 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -66.41 -29.26 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 96.0 mt -63.5 -49.04 75.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 10.0 110.215 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.596 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -66.18 -40.22 90.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.622 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 18.9 m -63.5 -35.34 80.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.081 0.467 . . . . 10.0 110.459 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.64 -5.0 85.87 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.068 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 10.1 m -89.22 -27.23 20.76 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.359 0.6 . . . . 10.0 109.81 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 12.6 mt -75.65 153.3 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.678 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.11 85.34 1.03 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.089 0.471 . . . . 10.0 110.433 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.443 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -97.32 177.45 5.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.066 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.9 mmm -80.71 35.31 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.151 0.426 . . . . 10.0 112.151 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mp -69.06 -28.74 66.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.246 0.546 . . . . 10.0 109.9 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.37 14.33 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.05 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . 0.424 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -74.78 -58.99 3.88 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.749 -0.66 . . . . 10.0 112.84 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 29.0 Cg_endo -62.95 166.16 14.84 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.556 2.17 . . . . 10.0 112.246 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -49.1 79.0 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.831 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -147.57 115.04 6.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.698 0.285 . . . . 10.0 110.564 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -85.03 91.46 8.09 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.867 -0.419 . . . . 10.0 109.867 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.6 166.69 23.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.575 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.13 -32.12 73.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.619 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -63.94 -38.28 90.49 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.563 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.1 tp10 -72.24 -24.32 61.36 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.91 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -74.96 -30.38 61.19 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -84.32 -52.96 5.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.26 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.535 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 50.5 mt-10 -124.94 100.36 6.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.904 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.563 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -85.01 114.93 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.986 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -93.17 114.74 27.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.96 0.41 . . . . 10.0 111.117 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.665 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 71.9 m-85 -93.68 151.93 19.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.881 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -125.05 130.44 52.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.829 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 69.74 8.54 6.77 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.815 -0.63 . . . . 10.0 112.083 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.469 ' HA ' ' HD3' ' C' ' 48' ' ' PRO . 61.4 mt -105.44 114.58 63.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.692 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 11.8 Cg_exo -73.06 142.78 34.99 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.931 2.421 . . . . 10.0 111.708 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.7 p -60.9 -33.37 73.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.66 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -51.9 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.936 -0.574 . . . . 10.0 111.667 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.58 ' HB ' HD21 ' C' ' 85' ' ' LEU . 26.7 m -78.67 -27.65 14.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.721 0.296 . . . . 10.0 111.268 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 40.3 tp -65.79 -32.88 74.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.074 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 84.5 p -61.28 -39.3 89.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.637 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -65.93 -32.83 74.55 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.655 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.07 -47.64 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 10.9 m -62.93 -40.07 96.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.797 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 54.8 ttm -63.26 -45.74 90.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.252 -0.885 . . . . 10.0 110.431 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.519 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.4 t80 -63.52 -41.76 98.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.45 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.1 m-85 -61.88 -45.07 95.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.379 179.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 51.4 m -59.98 -42.12 93.49 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.304 0.574 . . . . 10.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.51 -41.63 96.3 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.404 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 tptt -63.11 -39.27 94.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.18 -0.464 . . . . 10.0 111.042 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.596 HG22 ' HB ' ' C' ' 20' ' ' THR . 71.1 t -59.2 -48.42 86.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.126 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.584 ' HG3' ' HB3' ' B' ' 69' ' ' PRO . 13.4 mmt180 -70.7 -41.01 72.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.157 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.694 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 78.4 t80 -57.61 -43.74 84.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.257 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 24.99 2.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.144 0.497 . . . . 10.0 111.267 -179.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -135.53 -58.52 0.78 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.627 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.39 -28.8 2.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.322 0.49 . . . . 10.0 112.322 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.694 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.2 m -86.93 32.93 0.66 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.37 5.48 20.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 10.0 111.048 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -103.69 -3.38 25.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.963 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.765 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.0 pt -111.36 167.23 9.37 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.118 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.765 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.1 Cg_endo -72.74 170.86 18.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.39 2.06 . . . . 10.0 113.08 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.7 tp10 -70.01 168.15 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.565 -0.743 . . . . 10.0 109.609 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.466 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 38.4 t80 -51.64 134.61 35.39 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 123.202 0.314 . . . . 10.0 110.647 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.7 121.52 8.12 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.067 2.511 . . . . 10.0 112.718 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 26.6 pt -84.25 44.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.799 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -101.64 -53.94 0.14 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 112.768 0.655 . . . . 10.0 112.768 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 21.4 Cg_exo -66.96 112.71 2.56 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.087 1.858 . . . . 10.0 112.598 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.487 ' HA ' HD21 ' A' ' 16' ' ' LEU . 45.1 mt-10 -75.07 55.48 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.335 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . 0.557 HD11 ' H ' ' B' ' 117' ' ' VAL . 13.2 mm -120.36 -11.7 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 10.0 111.253 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.776 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.11 -40.36 82.57 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.631 HD23 HD11 ' A' ' 22' ' ' ILE . 6.5 tp -67.44 -30.73 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 10.0 110.282 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.437 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 9.4 mp0 -62.33 -35.95 80.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.877 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.758 ' HB3' HD21 ' A' ' 8' ' ' LEU . 75.2 mt -76.39 -31.58 58.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.845 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.9 tt -64.71 -27.49 68.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.351 -0.841 . . . . 10.0 110.614 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . 0.517 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 19.8 ttp -60.51 -19.18 56.14 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.904 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.94 -34.19 74.33 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.689 -0.232 . . . . 10.0 111.106 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.69 -57.64 0.5 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.208 0.818 . . . . 10.0 113.208 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -81.91 38.6 0.53 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.954 0.407 . . . . 10.0 111.657 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.528 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 1.6 t80 . . . . . 0 C--O 1.244 0.806 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.578 -0.209 . . . . 10.0 112.578 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -59.22 4.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.743 0.646 . . . . 10.0 112.743 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.8 tp -62.04 -31.77 72.21 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.891 0.377 . . . . 10.0 110.836 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -56.34 -33.85 66.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.786 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -97.27 -40.36 8.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.891 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.57 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.6 mt -60.61 -39.33 87.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.953 -0.567 . . . . 10.0 112.441 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.43 -36.58 81.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 10.0 111.155 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 tp -69.89 -37.3 75.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.178 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.46 -22.03 61.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.352 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.54 -51.49 7.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.087 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.0 tp -141.61 112.92 7.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.524 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.557 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 26.7 mt -80.63 93.53 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.22 -1.03 . . . . 10.0 108.22 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.416 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 85.5 tttt -106.19 94.15 9.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.678 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.557 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 3.0 Cg_endo -87.19 88.98 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.995 2.463 . . . . 10.0 110.683 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -138.43 -176.79 4.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.992 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -89.11 158.94 17.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.192 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.3 mm -100.68 162.45 3.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.406 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.9 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 1.5 tmtm? -177.75 128.14 0.3 Allowed Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.9 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 64.9 Cg_exo -39.44 138.07 0.84 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.739 2.959 . . . . 10.0 113.421 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.705 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.2 Cg_endo -57.74 138.14 84.61 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.965 2.444 . . . . 10.0 112.211 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 14.0 mt -71.53 121.74 85.22 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 24.0 Cg_endo -62.38 -23.63 75.23 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.886 2.391 . . . . 10.0 112.248 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -35.38 77.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.247 0.546 . . . . 10.0 109.975 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -116.07 -132.78 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.355 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -160.75 52.69 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.327 0.584 . . . . 10.0 109.989 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.6 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 15.0 tttm -154.6 149.32 26.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.843 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.705 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.7 pp -73.77 156.08 38.21 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.506 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -171.52 1.99 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.502 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -130.38 129.11 42.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.815 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -169.28 -63.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.073 0.463 . . . . 10.0 110.609 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.79 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-N 114.757 -1.11 . . . . 10.0 109.006 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tmm? . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.568 0.223 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.98 137.03 33.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.309 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.463 HG11 HD13 ' B' ' 57' ' ' LEU . 88.5 t -125.3 124.93 68.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.124 0.488 . . . . 10.0 111.263 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.739 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 61.8 m-85 -111.54 112.84 24.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.142 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.801 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -131.43 163.01 28.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.798 0.333 . . . . 10.0 111.191 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.7 mtm -128.54 108.27 10.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.2 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.43 HD13 ' HB ' ' B' ' 75' ' ' VAL . 49.7 mm -81.62 98.99 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.44 -0.948 . . . . 10.0 108.44 178.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.547 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.0 ttt180 -98.58 103.54 15.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 113.016 0.747 . . . . 10.0 113.016 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.5 ' HB2' HD23 ' B' ' 77' ' ' LEU . 27.5 ttp85 -89.27 72.09 8.16 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.102 -1.444 . . . . 10.0 107.102 177.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 67.87 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.058 -0.974 . . . . 10.0 110.139 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -107.94 -12.6 15.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.799 0.333 . . . . 10.0 111.108 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.481 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -95.65 91.75 6.27 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.094 -0.336 . . . . 10.0 110.094 179.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 5.2 m -94.57 120.24 34.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.005 0.431 . . . . 10.0 110.815 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.62 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 60.8 mt -109.99 119.38 58.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.685 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -74.34 117.22 15.9 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.801 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.9 OUTLIER -108.33 112.3 24.67 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.201 0.524 . . . . 10.0 111.813 -178.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.9 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.9 t70 -104.44 101.66 11.34 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.67 -167.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.871 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.409 ' O ' HD12 ' B' ' 57' ' ' LEU . 10.4 mmtt -123.48 161.7 24.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.47 -26.03 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.871 0.367 . . . . 10.0 111.63 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.82 -15.28 60.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.89 -0.596 . . . . 10.0 111.625 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 9.2 m -74.85 143.76 43.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.258 . . . . 10.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 19.2 p -94.94 165.9 12.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.822 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.433 HG13 HD12 ' B' ' 44' ' ' LEU . 53.9 t -63.99 -37.42 79.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.815 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -62.93 -35.1 78.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.451 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.439 ' O ' HG13 ' B' ' 30' ' ' ILE . 30.3 mt-10 -63.94 -36.11 82.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.419 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.944 HD11 HD21 ' B' ' 57' ' ' LEU . 63.6 mt -62.01 -44.6 96.37 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.04 -40.31 93.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.963 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -64.86 -37.15 86.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.272 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.439 HG13 ' O ' ' B' ' 26' ' ' GLU . 96.3 mt -64.13 -47.02 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.9 t -64.46 -33.74 64.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.248 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.756 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 6.8 tt0 -57.86 -40.02 79.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.629 179.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.53 -2.52 90.54 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.654 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.1 mt -106.8 -51.6 7.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.944 0.402 . . . . 10.0 111.281 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.58 -7.67 49.54 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.238 0.459 . . . . 10.0 112.238 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 62.39 29.48 17.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.932 0.396 . . . . 10.0 111.422 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.422 ' HA ' ' HD3' ' B' ' 37' ' ' ARG . 9.7 mmt180 -114.99 136.63 22.61 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.19 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.94 128.8 31.76 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.282 2.654 . . . . 10.0 112.684 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.756 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 51.5 Cg_endo -69.57 -14.46 36.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.384 2.723 . . . . 10.0 111.812 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.78 -43.72 85.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -99.12 14.54 28.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.921 -0.581 . . . . 10.0 112.096 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -87.07 127.2 35.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.211 -0.45 . . . . 10.0 109.929 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 31.8 mmt-85 -115.34 115.2 26.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.433 HD12 HG13 ' B' ' 24' ' ' VAL . 84.6 mt -97.29 115.09 27.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.224 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.16 111.6 22.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.06 0.457 . . . . 10.0 111.819 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -111.21 128.35 55.89 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.977 -1.12 . . . . 10.0 107.977 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 60.99 32.06 19.92 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.29 0.567 . . . . 10.0 109.776 -179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 68.34 17.45 9.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.148 -0.933 . . . . 10.0 111.791 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -125.31 149.99 47.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.071 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 28.8 tp -79.22 136.97 37.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.627 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 86.5 mt -86.26 174.86 8.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 10.0 111.736 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -110.57 125.48 53.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -62.26 -27.64 69.15 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -178.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.63 2.11 79.79 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.686 -0.768 . . . . 10.0 113.973 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -105.14 148.7 26.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.081 0.44 . . . . 10.0 111.282 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.7 p -83.85 166.85 17.58 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.882 179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.944 HD21 HD11 ' B' ' 27' ' ' LEU . 44.3 mt -57.94 -41.53 82.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.406 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.82 93.74 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.795 -0.717 . . . . 10.0 111.81 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.87 -24.59 65.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.768 0.318 . . . . 10.0 111.157 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 84.8 m -84.53 5.04 29.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.927 0.394 . . . . 10.0 111.854 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.76 14.67 60.82 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.679 -0.772 . . . . 10.0 114.149 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -87.17 79.43 8.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 117.134 0.467 . . . . 10.0 110.748 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 73.3 p -97.64 167.67 10.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.51 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 10.0 111.281 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -77.08 -35.37 56.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.739 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -90.05 -32.73 16.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.042 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.739 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -110.09 98.87 8.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.272 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -114.73 155.26 46.45 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.297 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.493 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 29.0 Cg_endo -64.48 -16.49 55.41 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.229 1.952 . . . . 10.0 111.342 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -106.2 -1.03 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.466 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.978 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -158.04 88.44 2.39 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.879 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.533 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.6 Cg_exo -78.3 140.18 17.2 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.821 2.348 . . . . 10.0 111.18 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.25 114.55 6.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 10.0 111.459 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.75 114.05 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.497 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.43 ' HB ' HD13 ' B' ' 7' ' ' ILE . 51.4 t -116.42 133.54 62.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.05 135.42 13.69 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.2 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.8 tp -114.38 107.06 15.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.792 0.33 . . . . 10.0 111.351 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.636 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -100.69 145.17 28.77 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -125.13 114.75 19.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -77.88 99.78 6.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.13 0.49 . . . . 10.0 111.44 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.408 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -117.74 128.54 54.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.21 131.91 51.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.822 0.304 . . . . 10.0 111.822 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 9.5 t70 73.27 -0.3 3.42 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.62 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 10.9 m -104.28 100.28 10.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.12 0.486 . . . . 10.0 110.518 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -67.78 -10.23 50.89 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.704 0.631 . . . . 10.0 112.704 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.426 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.7 tt0 -60.17 -22.84 63.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.942 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.02 -29.85 68.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.043 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 65.3 mt -83.73 -32.42 25.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.76 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.1 m -66.19 -37.08 84.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.741 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 2.4 mt -92.3 11.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.889 0.376 . . . . 10.0 111.585 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.5 101.49 17.63 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.821 0.343 . . . . 10.0 110.652 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 32.6 Cg_exo -63.84 -10.17 21.6 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.411 2.74 . . . . 10.0 112.8 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.01 -28.8 35.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.048 0.452 . . . . 10.0 110.999 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 11.8 m -113.84 -21.16 10.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.925 0.393 . . . . 10.0 111.596 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.463 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.8 m -126.57 149.25 67.47 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.376 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.89 162.42 41.98 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.634 2.223 . . . . 10.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.19 150.09 71.26 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.43 2.086 . . . . 10.0 111.652 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.55 84.41 3.93 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.291 0.567 . . . . 10.0 110.915 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.5 tp -108.49 122.46 40.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.115 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.8 Cg_exo -66.24 130.31 23.73 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.754 2.302 . . . . 10.0 111.06 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -35.71 81.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.025 0.441 . . . . 10.0 111.145 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.516 HG23 ' HG2' ' B' ' 103' ' ' MET . 30.6 m -73.07 -18.48 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.753 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.548 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 90.0 mmm -111.53 28.55 8.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.754 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.52 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 88.0 tttt -94.76 -51.04 0.25 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 112.807 0.669 . . . . 10.0 112.807 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 10.7 Cg_exo -72.9 56.54 3.01 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 122.593 2.195 . . . . 10.0 112.403 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 14.5 mt-30 -132.29 127.91 36.64 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -73.98 146.77 43.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.859 0.361 . . . . 10.0 111.913 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.7 m -63.82 139.05 58.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.745 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.21 -117.62 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.867 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.66 -37.94 6.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.997 0.427 . . . . 10.0 111.089 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.978 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 13.8 m -95.13 169.78 9.87 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.782 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.46 142.1 39.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 70.92 -5.49 1.48 Allowed 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.573 0.546 . . . . 10.0 111.361 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -84.64 112.08 20.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.263 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.462 ' HB3' ' HB2' ' B' ' 106' ' ' GLN . 43.8 mt-30 -106.72 143.66 34.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.255 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.18 114.29 26.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.6 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -71.91 132.25 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.057 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.086 0.469 . . . . 10.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.683 0.278 . . . . 10.0 111.083 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.566 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.0 ttpt -113.2 113.43 25.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.45 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.427 HD22 ' HE2' ' C' ' 44' ' ' PHE . 40.0 mt -90.46 121.46 32.45 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 42.1 mt -106.04 130.0 58.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.088 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -101.3 170.63 8.11 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.625 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -59.15 -24.6 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -81.65 -2.65 51.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.319 . . . . 10.0 111.454 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.66 12.64 74.59 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.812 -0.709 . . . . 10.0 111.561 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.48 124.45 28.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.494 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 16.6 mt-10 -99.86 121.83 41.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.018 -179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -113.51 112.55 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.777 0.323 . . . . 10.0 111.504 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.62 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 13.8 mm -89.54 119.25 36.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.2 t -104.55 134.99 44.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.9 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 69.2 tttt -62.69 128.94 38.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' C' ' 15' ' ' ARG . 29.8 ttt180 -52.27 -38.04 57.13 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.379 0.424 . . . . 10.0 112.098 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.412 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.0 tt0 -54.59 -44.17 72.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.924 0.392 . . . . 10.0 111.206 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -80.22 -35.06 36.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.169 0.509 . . . . 10.0 110.215 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.36 87.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.51 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 74.6 mt -58.71 -50.67 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.585 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.26 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.486 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.2 m -64.99 -34.65 78.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.167 0.508 . . . . 10.0 109.858 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.87 -2.05 90.0 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.824 -0.625 . . . . 10.0 112.291 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -88.59 -23.4 23.12 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 17.3 mt -80.76 152.78 4.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -72.26 80.86 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 10.0 110.769 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.33 165.98 14.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.42 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 85.5 mmm -78.85 40.4 0.39 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.26 -24.76 64.02 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.344 -0.614 . . . . 10.0 109.344 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.33 14.36 13.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.01 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.22 -61.73 6.99 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 115.835 -0.621 . . . . 10.0 113.138 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -71.49 -165.87 0.22 Allowed 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.679 2.253 . . . . 10.0 112.243 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.0 -51.57 10.17 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.589 -0.815 . . . . 10.0 112.219 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -144.15 142.53 30.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.82 0.343 . . . . 10.0 110.233 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -114.22 88.45 2.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.757 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.84 161.53 30.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.077 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.35 -31.0 69.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.331 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -64.11 -38.5 91.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.152 0.501 . . . . 10.0 110.254 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.429 ' O ' HG22 ' C' ' 42' ' ' VAL . 22.0 tp10 -73.4 -24.69 60.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.637 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -78.34 -11.63 59.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.051 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -86.46 -55.34 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.674 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.566 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 53.9 mt-10 -129.75 91.65 3.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.359 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.429 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.7 t -78.24 124.38 36.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.309 -0.405 . . . . 10.0 109.961 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -98.79 106.26 18.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 10.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.474 ' HB3' HD12 ' C' ' 47' ' ' ILE . 81.1 m-85 -88.05 91.35 8.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.159 0.504 . . . . 10.0 110.939 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 47.8 mtt180 -76.09 134.91 39.9 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.29 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 4.7 mm-40 77.47 4.6 3.1 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 124.018 0.824 . . . . 10.0 112.174 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.8 mt -109.18 115.97 55.9 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.549 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 23.8 Cg_exo -67.31 151.25 80.99 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 123.104 2.536 . . . . 10.0 111.926 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.1 p -63.0 -37.87 88.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.64 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -55.66 -55.27 34.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.901 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.6 -31.6 53.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.627 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 25.8 tp -65.54 -40.01 92.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.934 0.397 . . . . 10.0 110.102 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -62.32 -34.93 77.58 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.113 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -64.95 -39.81 94.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.894 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.73 -49.22 76.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.361 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 63.3 m -57.01 -41.39 78.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.158 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -64.51 -41.11 96.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.128 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.57 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 78.1 t80 -65.48 -41.83 92.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.652 179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.462 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.9 m-85 -63.57 -45.04 92.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 46.4 m -59.33 -43.97 92.67 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.451 0.643 . . . . 10.0 109.68 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.493 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 36.9 t80 -63.76 -44.59 93.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.135 179.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -61.39 -40.39 94.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.938 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.462 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.6 t -57.16 -52.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.858 0.361 . . . . 10.0 110.589 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -70.81 -38.24 73.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.248 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.71 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 76.8 t80 -56.73 -50.24 72.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.045 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.84 -13.33 59.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.87 0.367 . . . . 10.0 111.84 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 37.3 t30 -88.64 -44.82 10.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -154.39 -31.0 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.873 0.694 . . . . 10.0 112.873 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.71 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.7 m -74.8 29.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 -179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.1 -1.22 39.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.216 0.531 . . . . 10.0 110.399 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -76.5 -24.52 53.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.396 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.488 HG12 ' O ' ' C' ' 69' ' ' SER . 31.7 pt -96.13 166.17 14.87 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.428 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.86 175.74 8.58 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.928 2.419 . . . . 10.0 112.661 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -72.59 171.72 11.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.476 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -50.77 128.6 27.18 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.675 0.274 . . . . 10.0 111.043 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -53.89 128.01 27.91 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.185 2.59 . . . . 10.0 112.979 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.58 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.1 pt -85.48 41.72 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.149 0.499 . . . . 10.0 111.113 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -90.96 -55.89 0.26 Allowed Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.96 -0.563 . . . . 10.0 112.456 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 8.4 Cg_exo -72.14 128.58 14.05 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.888 1.725 . . . . 10.0 111.011 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -75.2 0.46 16.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.0 mm -85.85 99.35 7.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.272 0.558 . . . . 10.0 111.35 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -168.02 -42.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.049 -0.978 . . . . 10.0 109.457 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.416 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 29.1 tp -65.84 -26.86 67.85 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.622 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 29.6 mp0 -62.91 -31.84 72.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.9 -1.045 . . . . 10.0 109.884 178.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.705 ' HB3' HD21 ' A' ' 8' ' ' LEU . 66.4 mt -79.72 -35.12 39.41 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -23.99 67.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.403 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 49.5 ttp -58.99 -28.95 66.85 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.269 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . 0.51 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -58.03 -43.07 86.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.608 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.16 -52.42 0.59 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.164 1.172 . . . . 10.0 114.164 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -79.61 25.15 0.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.294 0.479 . . . . 10.0 112.294 -178.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.51 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 58.7 m-85 . . . . . 0 C--O 1.244 0.791 0 CA-C-O 118.699 -0.667 . . . . 10.0 109.625 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.539 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.453 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.44 -62.89 1.53 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.265 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' C' ' 85' ' ' LEU . 37.3 tp -61.01 -34.01 74.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.982 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.427 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 60.3 tt0 -58.53 -30.23 66.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.133 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -98.63 -38.32 9.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.02 0.438 . . . . 10.0 110.473 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.507 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 77.5 mt -63.4 -35.7 81.29 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.94 -0.573 . . . . 10.0 112.233 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.38 92.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 10.0 110.329 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.99 -22.83 62.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.125 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.17 -9.54 59.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.309 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.467 ' HB2' ' CE1' ' C' ' 58' ' ' TYR . . . -105.14 -51.16 3.08 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.407 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' C' ' 77' ' ' ILE . 0.2 OUTLIER -137.2 129.11 29.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.736 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.407 ' H ' HD12 ' A' ' 17' ' ' ILE . 2.5 mp -91.28 97.65 7.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 52.4 tttt -111.53 103.68 55.32 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.951 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -97.05 45.17 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.429 2.753 . . . . 10.0 111.611 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.555 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 28.9 mttt -93.28 -178.08 4.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.413 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -82.33 147.86 28.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.21 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.444 HD11 ' HG ' ' C' ' 83' ' ' LEU . 30.7 mm -110.33 106.45 20.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.15 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.006 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -121.87 135.49 25.32 Favored Pre-proline 0 C--N 1.32 -0.695 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.538 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.4 Cg_exo -34.25 135.12 0.13 Allowed 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 124.176 3.251 . . . . 10.0 113.6 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.723 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 13.4 Cg_endo -56.64 141.09 91.49 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 123.293 2.662 . . . . 10.0 112.511 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.434 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -78.81 118.42 72.31 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.763 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 19.9 Cg_endo -59.98 -21.27 64.22 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.391 2.727 . . . . 10.0 113.165 -179.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -63.97 -34.55 78.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.818 0.342 . . . . 10.0 111.095 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.668 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.3 t -122.68 -112.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -175.21 61.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.185 0.517 . . . . 10.0 111.095 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.3 tttm -159.85 151.87 20.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.447 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.723 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -70.76 156.64 39.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.818 0.342 . . . . 10.0 110.744 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -103.01 170.81 7.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.107 -179.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -119.88 111.89 18.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.844 0.354 . . . . 10.0 110.741 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.006 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -151.57 -72.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.183 -179.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.41 -62.63 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.309 -0.853 . . . . 10.0 109.511 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.877 0.37 . . . . 10.0 111.022 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -166.69 121.72 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.671 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.27 117.14 48.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.996 0.427 . . . . 10.0 110.856 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.42 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 68.8 m-85 -104.25 115.47 30.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.653 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.746 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -130.71 156.33 45.12 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.892 0.377 . . . . 10.0 111.37 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.555 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 55.2 mtm -125.61 111.81 15.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.874 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.548 HD13 ' HB ' ' B' ' 75' ' ' VAL . 42.8 mm -82.19 104.32 10.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -100.27 97.39 8.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.547 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.0 ttp85 -89.19 75.71 7.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.7 -1.222 . . . . 10.0 107.7 177.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 22.3 t-80 67.13 -87.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.448 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -113.67 11.09 18.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 10.0 111.001 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 5.8 m -116.61 96.92 5.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.383 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.423 ' OG1' ' HE1' ' C' ' 9' ' ' HIS . 24.6 m -96.13 121.14 37.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.897 0.38 . . . . 10.0 110.933 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.567 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.1 mt -112.21 119.19 59.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.358 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.16 122.84 26.18 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.746 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -116.6 118.39 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.036 0.446 . . . . 10.0 112.003 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -103.4 101.58 11.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.96 -169.4 2.03 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.275 0.36 . . . . 10.0 110.784 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -127.54 163.82 23.33 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.6 -25.83 64.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -18.94 60.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.839 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . 0.406 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 10.8 m -71.68 141.26 49.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.615 -0.266 . . . . 10.0 110.729 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.3 p -91.78 163.96 13.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.625 -0.261 . . . . 10.0 110.63 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.432 HG21 ' HB3' ' B' ' 51' ' ' LEU . 65.2 t -63.78 -36.32 76.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.925 0.393 . . . . 10.0 110.577 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -61.29 -36.13 79.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.645 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -63.33 -34.26 77.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.171 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.67 HD11 HD21 ' B' ' 57' ' ' LEU . 75.1 mt -61.58 -42.58 99.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.0 -32.03 73.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.283 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' B' ' 29' ' ' ARG . 19.0 mtp180 -66.08 -39.5 90.09 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 70.1 mt -67.33 -43.46 87.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.6 t -61.57 -38.09 79.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.432 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 38.4 tt0 -62.41 -30.12 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.537 . . . . 10.0 110.271 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.73 -0.14 86.2 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.869 -0.682 . . . . 10.0 112.362 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.9 mt -115.64 -55.29 4.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 10.0 111.079 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 66.4 mt -88.42 -11.5 45.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.453 -0.339 . . . . 10.0 111.138 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 46.4 mttt 55.7 52.84 10.31 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.918 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.63 146.57 62.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.689 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -54.49 121.76 10.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.963 2.442 . . . . 10.0 112.268 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.74 -16.65 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.783 2.322 . . . . 10.0 111.928 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -26.75 65.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.387 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -101.22 9.62 41.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.229 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -95.03 131.12 41.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.453 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 56.8 mmt-85 -117.9 114.26 22.96 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 82.1 mt -94.15 117.77 30.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.779 0.324 . . . . 10.0 110.56 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -111.44 124.5 52.39 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 112.268 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 38.9 tttm -127.22 128.34 45.9 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 61.59 31.66 18.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.899 0.381 . . . . 10.0 110.642 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 70.91 13.44 7.04 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.378 -0.828 . . . . 10.0 111.89 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -124.25 144.89 49.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.804 0.335 . . . . 10.0 111.039 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 42.4 tp -73.26 127.69 33.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.502 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.432 ' HB3' HG21 ' B' ' 24' ' ' VAL . 97.1 mt -70.46 155.76 40.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.027 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 20.3 t0 -87.27 118.21 26.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.647 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.81 -28.1 68.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.825 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.91 24.39 32.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.454 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 23.8 mttp -127.78 160.16 32.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.963 0.411 . . . . 10.0 111.02 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 35.0 p -89.12 166.59 13.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.215 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.67 HD21 HD11 ' B' ' 27' ' ' LEU . 44.0 mt -59.35 -40.53 86.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.01 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.07 -39.9 96.38 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.875 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -72.83 -17.39 61.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.962 0.41 . . . . 10.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 60.2 m -94.91 5.96 50.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.728 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.52 16.89 63.17 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.71 -0.757 . . . . 10.0 113.355 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 36.9 m-85 -84.64 63.62 8.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.151 0.5 . . . . 10.0 110.451 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 3.5 p -84.85 149.83 25.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.12 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 2.3 m -62.49 -21.58 65.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.992 0.425 . . . . 10.0 110.673 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -63.76 -30.26 71.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.208 -0.451 . . . . 10.0 109.904 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.16 5.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.751 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.42 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -90.58 87.84 6.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.164 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -100.11 159.55 29.51 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.112 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.86 -16.76 55.84 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.638 2.225 . . . . 10.0 111.897 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.412 ' HB2' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER -113.67 5.95 16.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.442 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.606 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -156.26 79.05 4.08 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.339 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.555 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.6 Cg_exo -74.29 141.78 29.37 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.612 2.208 . . . . 10.0 111.545 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.09 123.53 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.069 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 123.6 24.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.571 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.548 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.0 t -123.77 129.19 74.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.55 133.43 11.8 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.697 -0.763 . . . . 10.0 111.896 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.4 tp -110.29 99.1 8.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.009 0.433 . . . . 10.0 111.116 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.453 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -95.65 114.3 26.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.013 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -97.84 118.77 35.15 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -83.46 100.86 11.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.146 0.498 . . . . 10.0 111.244 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -120.36 141.11 50.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.695 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.61 137.51 54.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 4.7 t70 70.79 11.81 7.16 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.409 0.623 . . . . 10.0 110.854 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 9.4 m -111.68 98.85 7.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.214 0.531 . . . . 10.0 111.063 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -72.78 -17.92 61.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.576 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 30.0 tt0 -56.98 -26.05 59.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.641 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.67 -16.8 61.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.71 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 58.7 mt -93.4 -15.57 25.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.949 0.404 . . . . 10.0 111.345 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 24.0 m -91.93 -30.26 16.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.115 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.2 mt -85.45 -3.3 8.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.29 0.567 . . . . 10.0 110.597 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -100.38 110.29 59.59 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.152 -0.477 . . . . 10.0 111.079 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 59.7 Cg_endo -72.72 -1.67 10.71 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.027 2.485 . . . . 10.0 111.736 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -84.57 -24.37 29.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.195 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -112.79 -39.4 4.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.599 -0.728 . . . . 10.0 111.064 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 25.5 m -117.34 155.62 49.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.978 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.16 154.98 42.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.558 2.172 . . . . 10.0 111.912 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.44 135.22 68.15 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.855 2.37 . . . . 10.0 112.014 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -76.69 106.08 8.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.316 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 27.4 tp -141.64 121.29 8.2 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.687 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 26.0 Cg_exo -64.81 133.15 35.13 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.535 2.157 . . . . 10.0 111.687 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -60.72 -27.67 68.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.53 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.668 ' HB ' HG13 ' A' ' 29' ' ' VAL . 18.1 m -65.02 -25.14 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.279 0.561 . . . . 10.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.493 ' HG2' HG23 ' B' ' 102' ' ' VAL . 83.4 mmm -121.47 54.88 1.1 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.281 -1.007 . . . . 10.0 108.281 179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.648 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 69.7 tttt -126.87 -54.96 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.465 -0.789 . . . . 10.0 112.445 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 3.5 Cg_exo -82.23 70.11 7.18 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.633 2.222 . . . . 10.0 111.645 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -128.64 -167.41 1.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.796 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.784 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.6 t70 -93.41 179.78 5.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 8.6 m -110.7 136.57 49.58 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.66 0.267 . . . . 10.0 110.402 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -86.35 -147.71 11.07 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.511 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 3.6 m -111.66 -22.47 11.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.334 0.588 . . . . 10.0 110.348 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.625 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.0 OUTLIER -86.63 159.79 19.1 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.604 -0.725 . . . . 10.0 109.918 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . 0.606 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.4 121.95 15.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 t30 69.94 17.28 7.51 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.782 0.677 . . . . 10.0 111.572 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.625 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 65.4 tt0 -81.78 129.54 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.995 0.426 . . . . 10.0 110.249 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -110.13 143.04 40.79 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.097 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -114.09 105.76 13.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.353 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.418 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 1.9 t -72.38 137.65 23.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.911 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.447 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 22.5 mp0 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.494 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.89 0.376 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -104.16 108.36 19.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.174 -0.467 . . . . 10.0 111.181 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.704 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 47.8 mt -81.8 126.66 32.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.527 HD11 ' HB3' ' C' ' 41' ' ' GLU . 40.9 mt -108.13 114.14 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.813 0.34 . . . . 10.0 110.582 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.66 165.66 16.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.674 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m -61.65 -25.68 67.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.908 0.385 . . . . 10.0 111.655 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -79.02 0.15 28.86 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.647 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.71 26.22 59.15 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . 0.423 ' HE1' ' OG1' ' B' ' 13' ' ' THR . 6.8 t-80 -91.08 138.79 31.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.44 . . . . 10.0 110.381 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.58 132.53 49.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.316 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.704 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 59.9 m-85 -125.12 106.85 10.22 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.257 -0.428 . . . . 10.0 109.983 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.567 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 27.4 mm -88.68 110.81 21.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.148 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 43.1 t -98.51 125.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.04 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -59.74 128.25 35.99 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.298 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.46 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 33.0 ttt-85 -53.28 -31.26 42.94 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.33 -0.395 . . . . 10.0 111.639 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -52.34 -44.8 65.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.078 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -87.09 -30.03 21.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.514 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -62.42 -32.44 73.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.025 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.1 -46.87 87.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.739 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.439 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.6 m -72.61 -36.21 68.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.408 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 27.5 m -65.26 -24.07 67.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.146 0.498 . . . . 10.0 110.301 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.71 -8.33 82.96 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.694 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -87.74 -19.57 27.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.454 0.645 . . . . 10.0 109.584 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -79.21 148.35 6.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.313 -0.858 . . . . 10.0 109.312 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.7 79.8 0.84 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 10.0 110.697 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -90.01 172.87 8.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.313 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.539 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.8 mmm -82.87 38.59 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.11 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mp -66.8 -32.57 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.288 0.566 . . . . 10.0 109.811 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -90.17 14.54 12.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.957 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.56 -62.5 3.83 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.657 -0.701 . . . . 10.0 112.89 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.99 -167.5 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.726 2.284 . . . . 10.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.63 -90.01 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.962 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -116.08 132.33 56.69 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.706 -0.291 . . . . 10.0 110.534 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.76 92.95 8.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.306 -0.406 . . . . 10.0 109.987 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.73 176.51 8.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.187 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.37 -25.74 68.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.268 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.86 -48.07 78.18 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.458 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.2 mp0 -70.46 -24.45 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.246 -0.888 . . . . 10.0 111.324 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 5.1 m -78.29 -47.05 18.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.017 0.437 . . . . 10.0 110.621 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -70.83 -44.16 67.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.878 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.527 ' HB3' HD11 ' C' ' 4' ' ' ILE . 49.5 mt-10 -128.62 103.27 7.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.436 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.458 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -90.01 104.69 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . 0.431 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 14.6 t-20 -84.22 128.5 34.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.669 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.538 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 81.4 m-85 -109.15 124.43 50.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.345 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -96.41 128.1 43.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.334 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 67.48 19.76 9.93 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 10.0 112.79 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' C' ' 44' ' ' PHE . 67.2 mt -113.45 111.4 49.54 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.212 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.7 143.57 46.68 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 123.038 2.492 . . . . 10.0 111.645 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -34.9 70.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.904 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.11 -55.54 31.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 10.0 111.742 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.6 m -71.33 -30.42 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.99 -0.284 . . . . 10.0 111.002 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 43.9 tp -64.34 -35.9 82.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.447 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -59.59 -39.76 85.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.589 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -65.73 -36.18 82.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.315 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 36.3 t -68.53 -44.28 83.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.64 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.28 -42.3 98.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.614 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 72.1 mtm -66.4 -35.21 79.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.467 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.507 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 75.7 t80 -65.21 -42.65 93.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.174 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.47 ' O ' HG23 ' C' ' 63' ' ' VAL . 9.5 m-85 -62.39 -47.44 84.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.703 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.0 m -57.53 -42.46 82.92 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.944 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -64.48 -45.57 86.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.364 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptt -63.79 -34.83 78.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 112.006 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.47 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -62.01 -40.76 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.102 0.477 . . . . 10.0 110.52 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -84.52 -34.45 23.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.737 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.701 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 45.9 t80 -57.71 -57.33 13.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.027 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.97 54.47 3.1 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 0.8 OUTLIER -162.16 -58.87 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.322 -179.049 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.58 -33.82 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.634 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.701 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 7.2 m -87.12 35.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.082 0.468 . . . . 10.0 111.949 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -9.76 59.09 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.012 0.434 . . . . 10.0 110.535 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -92.95 -9.54 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.658 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 34.1 pt -100.17 164.36 16.53 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.155 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.61 164.23 27.2 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.625 2.217 . . . . 10.0 112.948 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.8 tp10 -72.63 170.63 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.315 178.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.477 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 29.9 t80 -48.15 128.24 12.3 Favored Pre-proline 0 C--O 1.233 0.197 0 O-C-N 123.295 0.372 . . . . 10.0 110.824 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.96 121.77 5.45 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.545 2.83 . . . . 10.0 113.395 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.576 ' HA ' ' HG ' ' A' ' 16' ' ' LEU . 2.7 pt -80.15 45.81 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.576 -0.738 . . . . 10.0 111.855 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.638 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.21 -57.5 0.1 Allowed Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 112.724 0.639 . . . . 10.0 112.724 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.638 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 2.6 Cg_exo -76.37 97.01 1.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.202 1.935 . . . . 10.0 111.59 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.77 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -74.28 59.81 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.684 0.624 . . . . 10.0 112.684 -179.525 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.1 mm -116.25 13.73 7.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.879 0.847 . . . . 10.0 108.942 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.56 -38.43 54.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.328 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 15.4 tp -66.58 -30.07 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.137 0.494 . . . . 10.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.542 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 17.5 mp0 -61.42 -35.77 78.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.397 -0.82 . . . . 10.0 109.827 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 8' ' ' LEU . 46.5 mt -80.73 -33.55 35.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.335 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 3.3 tt -63.13 -27.15 69.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.685 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.2 ttp -59.5 -20.73 57.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.767 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -42.06 88.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.606 0.241 . . . . 10.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.59 -50.94 0.51 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -79.98 12.15 2.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.883 0.373 . . . . 10.0 111.586 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.53 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 72.6 m-85 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.329 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.425 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.316 -0.314 . . . . 10.0 112.316 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -67.93 0.28 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.164 0.801 . . . . 10.0 113.164 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' C' ' 85' ' ' LEU . 41.8 tp -63.95 -32.31 73.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.585 -0.279 . . . . 10.0 111.514 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.408 ' HG3' ' HG ' ' C' ' 86' ' ' LEU . 63.0 tt0 -57.6 -42.77 83.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.041 0.448 . . . . 10.0 110.25 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -78.88 -40.28 32.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.994 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.447 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 83.4 mt -61.02 -32.77 72.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.62 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.86 -43.52 92.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.791 0.329 . . . . 10.0 110.544 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 tp -70.27 -22.73 62.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.44 0.638 . . . . 10.0 109.956 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.77 2.23 56.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.368 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -114.07 -39.41 3.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.157 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.7 OUTLIER -156.68 118.91 3.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.016 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.1 mt -86.48 85.57 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 13.9 ttpt -96.21 111.89 57.98 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.159 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -95.46 36.04 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.315 2.677 . . . . 10.0 111.352 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -82.29 -177.95 6.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.341 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.836 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 28.4 mm-40 -87.35 166.03 15.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.547 0.573 . . . . 10.0 112.547 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.0 mm -116.41 143.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.691 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.122 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 0.1 OUTLIER -168.83 143.03 2.52 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 1.122 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 65.8 Cg_exo -43.74 140.28 4.72 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.258 2.639 . . . . 10.0 112.526 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.817 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.2 Cg_endo -63.84 139.28 67.64 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.859 2.373 . . . . 10.0 111.826 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -76.44 125.72 87.19 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.66 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.59 -11.03 30.09 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.097 2.531 . . . . 10.0 112.936 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -42.38 76.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.135 0.493 . . . . 10.0 110.478 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -119.5 -125.51 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -159.41 55.56 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.38 0.61 . . . . 10.0 110.727 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 17.9 tttm -153.06 154.11 34.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.408 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.817 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -76.52 156.38 32.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.716 0.293 . . . . 10.0 110.935 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -95.53 169.91 9.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.601 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.836 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 25.1 tt0 -122.32 119.41 31.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.03 0.443 . . . . 10.0 110.967 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.086 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -153.17 -68.25 0.15 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.991 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.0 -56.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.806 -0.616 . . . . 10.0 109.875 179.908 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tmm? . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 121.02 0.438 . . . . 10.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -79.23 137.17 37.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.003 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.572 HG11 HD13 ' B' ' 57' ' ' LEU . 98.3 t -123.6 119.49 57.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.29 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.555 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.6 m-85 -109.3 115.03 29.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.994 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.792 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.8 OUTLIER -131.13 159.75 36.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.811 0.339 . . . . 10.0 111.39 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 35.0 mtm -127.52 106.17 8.99 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.862 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -78.36 105.39 7.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -107.62 104.15 13.62 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 -178.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.45 ' HB2' HD23 ' B' ' 77' ' ' LEU . 16.5 ttp85 -92.54 76.39 5.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.339 -1.356 . . . . 10.0 107.339 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.722 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.4 t-80 67.6 -81.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.428 -0.805 . . . . 10.0 111.083 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 mttt -113.87 -12.65 12.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.94 0.4 . . . . 10.0 111.743 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.5 105.14 17.37 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.6 m -106.68 120.48 42.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.63 0.253 . . . . 10.0 111.24 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.48 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 58.3 mt -113.44 118.09 57.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.81 -179.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -77.26 118.42 19.73 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.792 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -110.02 116.74 32.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.448 0.642 . . . . 10.0 112.003 -178.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.836 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -101.59 97.99 8.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.706 -1.22 . . . . 10.0 107.706 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.44 -169.69 1.9 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.222 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -127.43 158.49 37.2 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.73 -20.7 61.81 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.467 0.543 . . . . 10.0 112.467 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.19 -15.29 58.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.835 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 20.1 m -81.09 143.27 32.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.742 0.306 . . . . 10.0 111.367 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 40.0 p -90.55 168.28 11.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.455 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 57.2 t -64.63 -34.32 69.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.638 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -62.2 -35.94 80.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.412 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -63.5 -29.8 71.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.105 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.927 HD11 HD21 ' B' ' 57' ' ' LEU . 81.1 mt -67.21 -47.31 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -61.36 -33.34 73.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.877 -0.602 . . . . 10.0 110.573 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.55 -34.31 77.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.138 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.1 mt -70.57 -46.85 68.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.67 -36.41 73.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.327 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -57.58 -40.25 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.69 -14.66 79.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.85 -0.691 . . . . 10.0 113.241 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 88.0 mt -95.42 -51.94 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 122.663 -0.316 . . . . 10.0 111.399 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 46.1 mt -85.54 -11.63 53.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.452 0.538 . . . . 10.0 112.452 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.7 mttm 60.92 41.24 14.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' B' ' 37' ' ' ARG . 47.5 mtt-85 -131.82 151.55 78.76 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.85 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.42 131.51 46.67 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.308 2.672 . . . . 10.0 112.589 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.46 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 72.6 Cg_endo -77.95 -20.9 11.33 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.877 2.384 . . . . 10.0 111.971 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -70.68 -23.74 62.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -98.87 11.41 38.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.349 0.595 . . . . 10.0 111.194 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . 0.46 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 77.1 mt-30 -99.42 133.33 43.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.469 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.554 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 47.5 mmt-85 -115.0 118.22 32.8 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.492 ' HB3' HD12 ' B' ' 51' ' ' LEU . 41.1 mt -96.93 114.18 25.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.844 0.354 . . . . 10.0 111.144 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -112.33 127.23 55.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.137 0.494 . . . . 10.0 111.569 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -137.22 128.82 28.57 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.31 39.05 15.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.91 0.386 . . . . 10.0 111.214 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 64.27 17.06 10.51 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.353 -0.839 . . . . 10.0 111.808 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -128.72 155.19 45.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.858 0.361 . . . . 10.0 111.286 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.94 133.71 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.492 HD12 ' HB3' ' B' ' 44' ' ' LEU . 94.9 mt -76.77 155.95 32.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.835 0.35 . . . . 10.0 111.511 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -100.95 114.1 27.69 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.366 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.65 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 2.3 m-20 -64.86 -15.7 62.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.725 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.88 14.54 64.55 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.885 -0.674 . . . . 10.0 112.751 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -130.72 160.9 32.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.753 0.311 . . . . 10.0 110.693 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 43.4 p -86.6 165.56 16.09 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.927 HD21 HD11 ' B' ' 27' ' ' LEU . 84.7 mt -57.63 -39.68 77.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.398 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.06 85.33 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.998 -0.62 . . . . 10.0 112.382 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -81.15 -12.98 59.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.905 0.383 . . . . 10.0 111.507 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . 0.441 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 57.8 m -96.83 2.27 51.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 10.0 111.105 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.41 9.09 62.04 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.736 -0.745 . . . . 10.0 113.32 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.523 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 69.8 m-85 -86.28 62.6 7.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.233 0.539 . . . . 10.0 110.39 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.7 p -88.21 154.2 20.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.544 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.9 m -61.76 -15.36 40.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.053 0.454 . . . . 10.0 111.313 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -72.18 -38.21 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.263 0.554 . . . . 10.0 109.966 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.08 -46.11 7.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.554 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.555 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -87.76 92.85 9.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -99.4 154.11 37.45 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.17 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.96 -13.62 38.45 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.87 2.38 . . . . 10.0 112.078 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 3.9 pt20 -110.39 0.69 18.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.217 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.493 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -157.9 89.27 2.37 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.586 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.548 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.9 Cg_exo -74.03 141.78 30.22 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.742 2.295 . . . . 10.0 111.568 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.13 116.44 12.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.891 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.34 128.2 35.51 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.555 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 24.3 t -125.42 131.34 72.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.99 122.82 6.42 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.669 -0.777 . . . . 10.0 111.877 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' B' ' 9' ' ' ARG . 42.6 tp -101.53 106.16 17.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 10.0 111.128 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.554 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -101.07 105.51 16.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.458 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.04 117.65 30.04 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -81.7 106.19 13.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.008 0.432 . . . . 10.0 111.573 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.78 128.18 54.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.3 143.2 57.21 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.917 -0.313 . . . . 10.0 111.276 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.29 -3.39 1.85 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.515 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.46 96.17 5.29 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.539 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -77.72 12.65 1.59 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.955 -178.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -62.84 -26.83 68.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.65 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.08 78.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.972 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -70.0 -33.16 71.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.795 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.7 m -74.71 -30.78 61.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.774 -0.648 . . . . 10.0 111.21 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.722 HG12 ' HB2' ' B' ' 10' ' ' HIS . 59.0 mt -84.33 -35.29 10.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.252 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 28.6 tt0 -61.04 115.36 13.79 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.633 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.604 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.9 Cg_exo -65.93 -14.96 46.97 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.294 2.663 . . . . 10.0 112.51 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.59 -37.65 62.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.026 0.441 . . . . 10.0 110.147 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.37 -35.91 12.16 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.657 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.604 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 1.4 m -128.53 144.62 52.78 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.508 -0.314 . . . . 10.0 111.192 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.33 145.82 60.88 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.377 2.052 . . . . 10.0 111.083 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.66 128.61 28.92 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.896 2.397 . . . . 10.0 111.624 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -63.01 111.01 1.99 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.918 -0.583 . . . . 10.0 112.174 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 26.4 tp -131.08 131.56 23.25 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.048 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 31.3 Cg_exo -62.52 128.65 24.14 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 122.686 2.257 . . . . 10.0 111.733 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -65.41 -37.65 87.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.439 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' B' ' 103' ' ' MET . 28.1 m -67.22 -20.86 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.318 0.58 . . . . 10.0 110.694 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.506 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.3 mmm -114.65 52.98 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.027 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.714 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 33.1 tttm -126.27 -54.22 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 112.778 0.658 . . . . 10.0 112.778 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.714 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 72.8 Cg_endo -74.84 63.35 5.84 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.098 1.865 . . . . 10.0 111.858 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -128.92 -173.93 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.813 -0.631 . . . . 10.0 109.609 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.853 ' HB2' HE22 ' B' ' 118' ' ' GLN . 1.2 t70 -96.92 178.58 5.24 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.706 -0.397 . . . . 10.0 111.096 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -96.44 139.61 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.723 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . 0.424 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -89.13 -156.71 32.01 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.26 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.84 -34.23 16.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.092 0.472 . . . . 10.0 110.553 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.54 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.9 m -84.48 162.82 19.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.067 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . 0.493 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -70.18 129.08 38.41 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.17 4.45 4.9 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.757 0.661 . . . . 10.0 111.511 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.54 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 35.2 tt0 -75.4 141.06 43.3 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -118.19 147.19 43.61 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.091 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -120.32 109.86 15.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.225 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.482 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -77.23 137.41 22.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.122 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.853 HE22 ' HB2' ' B' ' 107' ' ' ASP . 16.3 mp0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.859 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.235 0.304 0 CA-C-O 120.932 0.396 . . . . 10.0 110.732 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.497 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.9 ttpt -102.42 111.15 23.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.956 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 66.3 mt -92.2 111.37 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -97.37 122.43 48.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.975 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 10.3 p -95.34 171.47 8.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.804 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.8 m -70.19 -7.59 43.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.839 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -91.64 -3.63 56.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.01 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.39 5.66 84.78 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.16 -0.776 . . . . 10.0 111.16 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.11 121.2 26.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -102.52 120.47 40.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.274 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -106.9 123.57 48.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.211 -0.45 . . . . 10.0 111.547 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.4 mm -100.7 117.69 46.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.844 -0.798 . . . . 10.0 108.844 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.15 139.68 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.603 -0.147 . . . . 10.0 110.603 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.836 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 56.2 tttt -56.44 130.41 44.72 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.405 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 33.7 ttt180 -53.99 -37.99 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.759 0.281 . . . . 10.0 111.759 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.519 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 35.2 tt0 -55.84 -53.21 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 10.0 110.842 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -66.77 -36.57 82.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.717 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.14 86.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.827 179.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 69.5 mt -61.27 -52.02 66.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.701 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.401 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.8 m -60.81 -41.43 95.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -64.74 -39.28 93.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.715 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.76 -10.88 80.64 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.121 -0.561 . . . . 10.0 112.662 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -82.69 -15.26 52.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.508 0.671 . . . . 10.0 109.743 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.1 mt -88.34 159.63 2.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -67.33 86.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.105 0.479 . . . . 10.0 111.435 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.92 165.91 11.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.969 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.425 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 96.3 mmm -76.8 41.89 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.92 -28.68 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.263 0.554 . . . . 10.0 109.835 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.89 15.49 22.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.236 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.45 -64.54 3.92 Favored Glycine 0 CA--C 1.52 0.391 0 CA-C-N 115.758 -0.655 . . . . 10.0 113.039 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.72 -154.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.612 2.208 . . . . 10.0 111.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.57 -94.95 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.743 -0.741 . . . . 10.0 112.089 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -113.41 112.01 22.92 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.827 0.346 . . . . 10.0 110.728 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -81.6 100.71 9.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.528 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.07 156.56 39.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.619 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.78 -37.29 73.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.073 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -62.96 -36.53 83.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -71.7 -31.5 66.82 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.206 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -73.75 -32.93 64.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.979 0.419 . . . . 10.0 110.306 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -75.59 -37.73 59.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.497 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 36.5 mt-10 -132.55 88.31 2.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.731 179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.5 117.71 26.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.374 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -95.73 110.87 22.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.244 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.515 ' HB3' HD12 ' C' ' 47' ' ' ILE . 93.7 m-85 -94.66 115.58 27.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.895 0.379 . . . . 10.0 111.354 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -99.07 136.83 38.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.395 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 70.15 27.48 4.22 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.893 0.746 . . . . 10.0 111.703 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.515 HD12 ' HB3' ' C' ' 44' ' ' PHE . 78.4 mt -132.89 109.92 13.05 Favored Pre-proline 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.307 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.511 ' HG2' HG22 ' C' ' 51' ' ' VAL . 30.1 Cg_endo -64.89 152.22 83.01 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.912 2.408 . . . . 10.0 112.575 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.3 p -63.99 -34.44 78.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.946 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . 0.504 ' HE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -54.17 -57.7 10.15 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.511 HG22 ' HG2' ' C' ' 48' ' ' PRO . 35.8 m -64.77 -35.24 74.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.427 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.5 tp -63.98 -37.51 87.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.61 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 35.5 m -59.71 -40.67 88.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.584 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -68.49 -35.94 78.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.337 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.51 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -62.97 -47.98 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.27 -40.95 92.19 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.553 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.6 mtm -65.55 -41.31 93.13 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 56.0 t80 -65.43 -40.83 93.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.603 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.419 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.8 m-85 -62.66 -46.65 87.23 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 35.6 m -58.4 -44.62 89.05 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.329 0.585 . . . . 10.0 110.146 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.457 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 34.4 t80 -64.85 -41.84 95.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.36 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -63.26 -38.71 92.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.247 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.419 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.4 t -60.75 -47.54 92.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.8 mmt85 -71.65 -40.81 69.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.361 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.518 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 60.5 t80 -58.64 -47.58 83.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.981 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.59 32.39 0.79 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.968 0.413 . . . . 10.0 110.952 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -138.83 -56.01 0.61 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.649 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.04 -35.83 0.62 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.713 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.518 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.4 m -80.67 38.76 0.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.951 0.405 . . . . 10.0 111.892 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.01 -17.03 32.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.45 0.643 . . . . 10.0 109.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -78.46 -14.78 59.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.489 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.756 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.46 166.85 12.15 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.377 -0.601 . . . . 10.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.756 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 44.7 Cg_endo -67.79 166.61 23.77 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.201 1.934 . . . . 10.0 113.247 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.565 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 7.9 tp10 -74.37 171.75 13.13 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.417 -0.957 . . . . 10.0 108.417 178.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.565 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 18.2 t80 -52.3 128.49 40.8 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 110.394 -0.224 . . . . 10.0 110.394 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 44.5 Cg_exo -57.01 129.55 35.09 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.811 2.34 . . . . 10.0 112.249 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.537 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.1 pt -84.05 40.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.307 0.575 . . . . 10.0 111.437 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.69 -57.3 0.36 Allowed Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.736 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -70.17 117.0 4.86 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.789 1.66 . . . . 10.0 110.778 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.519 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 3.3 pt-20 -73.98 3.73 6.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 43.0 mm -83.07 82.11 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.398 0.618 . . . . 10.0 110.026 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.65 -37.36 0.12 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.428 -0.805 . . . . 10.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.513 ' HB3' ' HE2' ' A' ' 18' ' ' LYS . 20.1 tp -66.2 -25.42 66.92 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 22.4 mp0 -63.39 -32.93 74.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.715 -1.129 . . . . 10.0 109.508 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 8' ' ' LEU . 80.5 mt -78.42 -34.2 48.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.759 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 9' ' ' GLN . 6.2 tt -66.2 -27.86 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.067 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 46.8 ttp -59.21 -25.9 64.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.548 -0.751 . . . . 10.0 111.752 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.19 -29.23 70.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.993 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.96 -65.35 0.22 Allowed 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.472 0.916 . . . . 10.0 113.472 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -80.18 33.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.896 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 112.744 -0.142 . . . . 10.0 112.744 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -56.41 22.57 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 8' ' ' LEU . 2.0 tp -57.6 -34.84 69.68 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.426 ' HA ' HD12 ' C' ' 86' ' ' LEU . 61.3 mt-30 -61.41 -37.19 82.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.045 0.45 . . . . 10.0 111.058 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -84.87 -41.95 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.52 -39.69 94.36 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.252 0.464 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.18 94.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.729 0.299 . . . . 10.0 111.011 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.83 -30.53 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.237 0.542 . . . . 10.0 110.475 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.07 -3.24 57.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.744 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.19 -41.0 5.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.426 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 0.2 OUTLIER -161.61 133.14 5.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.834 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.0 mt -99.69 100.41 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HB3' HD22 ' C' ' 83' ' ' LEU . 23.5 ttpt -108.89 101.66 45.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 10.0 111.283 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.55 71.36 4.68 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.308 2.672 . . . . 10.0 110.717 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 mttm -128.22 177.92 6.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.064 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -83.89 144.57 29.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.093 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.13 105.21 18.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.733 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.011 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -112.13 140.12 23.19 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 179.23 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.754 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 57.8 Cg_exo -40.36 132.53 2.31 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.47 2.78 . . . . 10.0 112.772 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.729 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.8 Cg_endo -59.11 141.36 98.03 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.282 2.655 . . . . 10.0 112.876 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.413 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -80.05 135.15 55.17 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.251 179.071 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.44 -7.5 21.39 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 122.862 2.375 . . . . 10.0 112.812 -178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -38.89 80.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.394 -0.367 . . . . 10.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 t -122.29 -117.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.23 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 7.5 ptp180 -166.75 49.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.992 0.425 . . . . 10.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.417 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.4 tttm -148.52 150.61 33.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.803 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.729 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.0 pp -74.47 156.03 37.38 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.769 0.319 . . . . 10.0 111.002 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -98.91 170.64 8.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.62 -179.079 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -119.16 125.72 49.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.011 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -166.76 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.84 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -174.73 -67.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.825 -0.435 . . . . 10.0 109.825 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.672 -0.68 . . . . 10.0 110.293 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.863 0.363 . . . . 10.0 110.579 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -81.68 143.08 32.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.039 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -133.22 112.26 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.868 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -97.92 110.15 22.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.167 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.628 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -122.18 153.71 38.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.937 0.399 . . . . 10.0 111.431 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 36.8 mtm -123.87 110.89 15.42 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.451 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.507 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -81.61 113.23 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.32 110.31 21.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.434 0.635 . . . . 10.0 112.635 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.421 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 28.5 ttp85 -103.36 68.63 0.97 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 107.034 -1.469 . . . . 10.0 107.034 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.559 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.8 t-80 66.16 -88.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.909 -1.041 . . . . 10.0 111.144 -178.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -96.8 -21.77 17.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.844 0.354 . . . . 10.0 111.455 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -90.1 120.3 31.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.495 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.49 125.13 48.16 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.989 -0.374 . . . . 10.0 109.989 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.598 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 63.8 mt -118.63 118.37 57.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.715 0.293 . . . . 10.0 111.6 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -80.73 115.34 20.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.628 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -112.08 112.32 23.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.076 0.465 . . . . 10.0 112.248 -178.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.62 100.75 13.43 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.639 -1.245 . . . . 10.0 107.639 177.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -120.65 -173.44 2.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.879 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 mmtt -125.88 160.57 29.55 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.03 -25.44 66.91 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.055 0.455 . . . . 10.0 111.203 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -2.18 49.63 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.9 m -86.74 141.28 29.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.685 0.279 . . . . 10.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.0 p -87.91 159.58 18.3 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.544 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 t -63.31 -35.22 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.919 0.39 . . . . 10.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.91 -35.94 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.58 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.401 ' O ' HG13 ' B' ' 30' ' ' ILE . 38.6 mt-10 -63.95 -34.62 78.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.048 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.92 HD11 HD21 ' B' ' 57' ' ' LEU . 78.4 mt -63.73 -44.98 91.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.27 -34.26 77.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.125 179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -65.64 -39.44 91.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.146 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 26' ' ' GLU . 73.7 mt -66.2 -42.73 91.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -63.14 -37.91 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.445 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.64 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.0 OUTLIER -63.67 -33.67 76.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.499 179.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.84 -26.57 66.69 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.495 -0.86 . . . . 10.0 112.458 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.4 mt -91.37 -57.49 4.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 70.0 mt -83.45 -15.48 49.44 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.384 0.512 . . . . 10.0 112.384 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 83.8 mttt 64.16 31.72 13.07 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.147 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.452 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 7.6 mmt180 -112.91 132.18 22.44 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.142 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 125.85 10.54 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.695 2.93 . . . . 10.0 113.436 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.64 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 43.1 Cg_endo -68.23 -20.39 43.25 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.938 2.425 . . . . 10.0 112.102 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.33 -31.76 73.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.287 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -98.97 10.86 40.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.036 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -93.67 128.37 39.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.859 0.362 . . . . 10.0 110.825 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.403 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 70.0 mmt-85 -118.72 111.2 18.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.031 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -93.28 121.14 34.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -114.78 122.12 45.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.13 0.49 . . . . 10.0 111.74 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.451 ' HG3' ' CZ ' ' B' ' 62' ' ' PHE . 4.5 tmtm? -118.19 123.52 45.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.401 -0.818 . . . . 10.0 108.833 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 57.4 43.19 23.57 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.443 0.465 . . . . 10.0 111.099 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 69.33 5.92 5.4 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -119.19 147.03 44.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.736 0.303 . . . . 10.0 111.549 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.23 132.47 43.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.521 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.8 mt -78.41 171.07 15.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -83.22 -157.53 0.24 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.603 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.62 -50.65 0.46 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.097 0.475 . . . . 10.0 110.012 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.18 -21.53 54.69 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.842 -0.694 . . . . 10.0 112.845 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -73.97 157.41 36.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.949 0.404 . . . . 10.0 111.013 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.6 p -90.64 169.25 11.16 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.465 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.92 HD21 HD11 ' B' ' 27' ' ' LEU . 79.2 mt -62.07 -35.59 79.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.598 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.04 -22.95 65.44 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.387 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -94.75 -6.53 42.84 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.756 0.313 . . . . 10.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 44.5 m -107.84 23.05 15.06 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.046 0.387 . . . . 10.0 112.046 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.94 28.09 71.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.961 -0.638 . . . . 10.0 113.519 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.451 ' CZ ' ' HG3' ' B' ' 46' ' ' LYS . 45.0 m-85 -107.26 99.41 8.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.904 0.383 . . . . 10.0 110.757 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -124.31 178.05 5.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 6.1 m -75.59 4.97 6.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.502 . . . . 10.0 111.154 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -97.31 -38.15 9.77 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.46 -39.79 18.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.197 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.77 107.52 17.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.776 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.507 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 66.8 mtt180 -118.91 161.74 34.77 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.103 -178.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.507 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 10.7 Cg_endo -53.69 -34.73 75.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.163 2.576 . . . . 10.0 113.264 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.579 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.33 11.37 27.21 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.233 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -151.01 77.09 7.75 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.674 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.1 Cg_exo -76.24 132.2 13.6 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.748 2.299 . . . . 10.0 111.617 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.18 122.79 18.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.546 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -78.46 126.15 30.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.478 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.507 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.3 t -121.77 130.33 74.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.14 135.28 13.52 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.653 -0.784 . . . . 10.0 111.84 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.3 tp -116.36 104.12 11.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.915 0.388 . . . . 10.0 111.333 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.403 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -97.95 119.55 36.77 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 66.3 t80 -98.96 123.16 43.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.286 -0.264 . . . . 10.0 110.286 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -75.03 78.09 2.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.279 0.561 . . . . 10.0 110.754 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.502 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -85.96 136.03 33.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -67.88 128.47 36.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.988 -0.551 . . . . 10.0 112.2 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.27 19.27 9.97 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.677 -0.692 . . . . 10.0 112.398 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.1 m -111.86 112.81 24.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.829 0.347 . . . . 10.0 110.529 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -77.44 -8.51 57.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.752 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.448 ' O ' HG13 ' B' ' 90' ' ' ILE . 54.7 tt0 -60.95 -28.63 69.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.367 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.19 -40.96 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.211 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.94 -21.31 60.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.371 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 30.5 m -83.83 -23.83 31.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.407 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' B' ' 10' ' ' HIS . 29.2 mt -90.53 -33.79 6.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.427 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.19 113.53 11.7 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.686 ' HA ' ' O ' ' B' ' 95' ' ' SER . 57.2 Cg_endo -71.66 -2.67 11.73 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.899 2.4 . . . . 10.0 112.182 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -80.53 -45.72 16.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.353 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -88.64 -28.96 20.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.811 -0.632 . . . . 10.0 111.542 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.686 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.3 m -132.29 136.55 28.26 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.647 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.1 151.24 79.94 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 122.553 2.169 . . . . 10.0 111.539 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.35 127.03 24.2 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.985 2.457 . . . . 10.0 112.12 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.58 120.85 14.13 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.773 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.418 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.5 tp -135.69 132.48 19.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.341 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.546 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 52.8 Cg_exo -58.22 127.7 25.87 Favored 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.635 2.223 . . . . 10.0 111.844 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.85 -36.47 83.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.958 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.424 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.3 m -73.15 -21.76 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.132 0.491 . . . . 10.0 111.104 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.546 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.7 mmm -111.42 62.18 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.65 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 83.7 tttt -131.27 -55.08 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.851 0.685 . . . . 10.0 112.851 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -74.74 62.42 5.62 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.484 2.123 . . . . 10.0 111.793 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -130.98 -178.24 4.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.915 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.574 ' HB2' HE22 ' B' ' 118' ' ' GLN . 1.2 t0 -90.35 177.69 6.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.873 0.368 . . . . 10.0 111.82 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 12.7 m -107.36 132.73 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.675 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . 0.498 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -85.15 -150.59 13.05 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.984 -0.627 . . . . 10.0 113.133 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.02 -41.76 11.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.002 0.429 . . . . 10.0 111.295 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.5 m -79.91 166.12 21.97 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.684 -179.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -73.55 127.9 34.01 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.0 t30 74.97 13.96 3.26 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.613 0.571 . . . . 10.0 110.954 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.498 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 28.4 tt0 -85.84 121.61 28.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -106.4 146.06 30.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.081 0.467 . . . . 10.0 111.545 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -119.1 105.4 11.36 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.238 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.34 127.23 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.537 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . 0.574 HE22 ' HB2' ' B' ' 107' ' ' ASP . 21.0 mp0 . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.091 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.918 0.389 . . . . 10.0 110.729 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.661 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -109.12 119.07 38.42 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.056 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 16.7 mt -96.18 117.84 31.55 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 179.177 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mp -103.63 113.2 39.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.791 0.329 . . . . 10.0 110.222 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.8 p -83.26 176.24 9.3 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.875 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.1 m -72.04 -7.06 46.66 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -93.82 -2.38 53.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.045 0.45 . . . . 10.0 109.832 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.71 9.7 80.65 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 10.0 111.867 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.12 123.09 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.676 0.274 . . . . 10.0 110.627 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.661 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 14.4 mt-10 -94.87 114.48 26.35 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.686 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 94.7 m-85 -104.07 107.08 17.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.598 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 10.8 mm -89.4 114.89 28.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.627 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.1 t -103.63 128.23 57.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.424 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -60.06 134.13 56.75 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.629 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 66.1 ttt180 -57.52 -28.81 63.81 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -55.51 -38.16 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.913 0.387 . . . . 10.0 111.139 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -95.09 -26.38 16.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.304 0.573 . . . . 10.0 110.148 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . 0.629 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -64.26 -33.51 75.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.632 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 75.2 mt -58.39 -51.5 69.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.229 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.548 ' O ' HG13 ' C' ' 24' ' ' ILE . 24.0 m -65.47 -41.26 93.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.432 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 24.3 m -58.39 -41.68 85.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.857 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.32 -15.36 81.21 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.982 -0.628 . . . . 10.0 112.575 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 38.7 m -82.13 -31.86 30.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.008 0.432 . . . . 10.0 110.166 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . 0.548 HG13 ' O ' ' C' ' 20' ' ' THR . 22.1 mt -69.87 158.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.205 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -71.4 87.03 0.85 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.078 0.466 . . . . 10.0 110.988 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -107.24 166.01 10.95 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.167 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.0 mmm -79.03 42.91 0.49 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.937 0.347 . . . . 10.0 111.937 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.34 -18.18 60.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.221 0.534 . . . . 10.0 110.427 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 15.9 m -101.05 14.59 31.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.85 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.97 -61.18 5.42 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.105 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.48 161.06 21.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.28 1.987 . . . . 10.0 111.968 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.71 23.82 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.943 -0.571 . . . . 10.0 112.621 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -127.27 113.56 16.46 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.939 0.4 . . . . 10.0 111.398 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -91.27 94.42 9.53 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.8 172.28 9.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -63.5 -14.93 55.94 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.593 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -55.78 22.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.775 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.414 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.6 tp10 -67.24 -31.64 72.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.939 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -62.57 -24.26 67.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.034 0.445 . . . . 10.0 111.034 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.37 -53.43 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.278 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -128.09 105.26 8.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.841 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.414 HG22 ' O ' ' C' ' 38' ' ' GLU . 4.1 t -84.22 121.59 36.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.796 0.331 . . . . 10.0 110.737 -179.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -90.39 103.82 16.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.71 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -98.19 112.88 24.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.182 0.515 . . . . 10.0 111.533 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -106.12 144.21 33.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 67.69 22.1 9.08 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.752 0.657 . . . . 10.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.2 mt -128.36 107.97 19.34 Favored Pre-proline 0 C--O 1.237 0.396 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.664 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -63.46 148.14 92.81 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.966 2.444 . . . . 10.0 111.837 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.1 p -59.76 -39.62 85.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.511 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . 0.464 ' CE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -53.57 -58.56 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 113.006 0.743 . . . . 10.0 113.006 -179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.408 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.3 m -62.71 -36.67 76.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 10.0 111.324 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 27.0 tp -64.09 -36.06 82.78 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.691 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 19.9 m -63.0 -40.6 98.26 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.292 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -66.79 -37.27 84.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.395 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.408 HG23 ' O ' ' C' ' 51' ' ' VAL . 89.6 t -62.26 -47.26 93.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.779 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -61.24 -39.2 89.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.838 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.0 mtm -65.01 -42.24 94.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.045 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -67.11 -39.79 86.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.416 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.512 ' O ' HG23 ' C' ' 63' ' ' VAL . 1.4 m-85 -60.89 -48.81 80.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.163 -0.472 . . . . 10.0 109.899 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 25.7 m -59.16 -40.92 87.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.214 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.579 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 27.8 t80 -64.01 -43.08 96.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.455 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -66.61 -34.22 77.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.166 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.512 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.1 t -62.17 -46.4 96.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -74.57 -38.05 62.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.804 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 12.8 t80 -58.59 -52.17 66.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.677 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -83.76 42.01 0.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.218 0.532 . . . . 10.0 110.539 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -152.77 -62.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.583 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.62 -36.02 1.45 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.909 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 20.4 m -82.5 43.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 111.932 -179.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 -5.01 48.91 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.603 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -92.0 -7.8 47.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.029 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 pt -102.38 161.9 21.89 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.467 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -65.67 164.48 26.44 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.749 2.3 . . . . 10.0 112.534 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.4 168.25 11.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.273 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -51.19 131.32 32.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 122.314 0.246 . . . . 10.0 110.971 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.5 124.45 15.18 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.131 2.554 . . . . 10.0 112.313 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.3 pt -83.64 45.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 10.0 111.231 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.624 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.22 -53.91 0.19 Allowed Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.956 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.624 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 14.8 Cg_exo -69.72 98.87 0.71 Allowed 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.062 1.841 . . . . 10.0 110.725 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 18' ' ' LYS . 44.3 mt-10 -68.69 3.61 1.81 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.042 0.756 . . . . 10.0 113.042 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . 0.488 ' HA ' ' OE1' ' C' ' 84' ' ' GLU . 20.2 mm -77.66 -2.94 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.522 0.677 . . . . 10.0 110.625 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.5 -28.94 67.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.622 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 18' ' ' LYS . 8.8 tp -77.51 -22.58 50.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.861 0.362 . . . . 10.0 110.846 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.488 ' OE1' ' HA ' ' C' ' 81' ' ' ILE . 9.1 mp0 -64.79 -26.14 68.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 10.0 109.651 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 mt -75.91 -27.31 57.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.703 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 9' ' ' GLN . 0.5 OUTLIER -68.65 -20.99 64.48 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.437 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.6 -23.62 67.46 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.915 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . 0.661 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -57.98 -44.35 87.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.347 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.82 -58.57 0.39 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -78.59 19.64 0.48 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.999 0.37 . . . . 10.0 111.999 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.661 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 81.1 m-85 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.98 -0.533 . . . . 10.0 109.638 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.489 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 111.801 -0.52 . . . . 10.0 111.801 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.575 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -57.82 -59.72 4.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.651 0.612 . . . . 10.0 112.651 -179.229 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.693 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.5 tp -65.66 -37.38 86.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.461 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -58.25 -24.5 59.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.146 0.498 . . . . 10.0 111.101 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -98.85 -46.78 5.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.104 0.478 . . . . 10.0 110.496 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.579 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 97.1 mt -63.43 -34.83 78.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.06 92.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.727 0.299 . . . . 10.0 111.324 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.3 tp -68.14 -28.85 67.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.522 . . . . 10.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.56 -10.29 59.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.283 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.3 -36.04 10.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.21 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.605 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.2 tp -151.1 121.72 7.46 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.265 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 mp -86.63 92.62 3.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.68 -0.859 . . . . 10.0 108.68 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' C' ' 83' ' ' LEU . 81.1 tttt -106.28 105.9 55.54 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.006 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -98.0 64.68 0.09 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.386 2.724 . . . . 10.0 110.802 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -124.8 170.84 10.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.018 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -77.44 145.49 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.529 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.881 HD11 HD23 ' C' ' 83' ' ' LEU . 44.2 mm -116.28 99.61 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.219 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.833 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 40.9 tttp -104.92 142.05 23.84 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 107.662 -1.236 . . . . 10.0 107.662 178.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -36.1 130.92 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.586 2.858 . . . . 10.0 112.912 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.805 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 10.6 Cg_endo -52.93 137.66 61.37 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.568 2.845 . . . . 10.0 113.165 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 125.08 83.31 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.252 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.95 -15.58 48.56 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.08 2.52 . . . . 10.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.19 -35.08 79.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.464 -0.335 . . . . 10.0 111.181 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -130.0 -127.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 109.996 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.506 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 4.9 ptp180 -155.22 52.29 0.61 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.136 0.493 . . . . 10.0 111.02 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -149.17 151.36 34.2 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.805 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -74.74 148.47 40.43 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.124 -0.324 . . . . 10.0 110.124 178.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.527 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -84.92 155.17 21.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.369 -179.466 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -107.59 110.82 22.8 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.833 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 21.7 t70 -162.43 -77.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.55 -69.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.731 -1.128 . . . . 10.0 109.397 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mmm . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.758 0.313 . . . . 10.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.3 141.16 35.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.119 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.417 HG11 HD13 ' B' ' 57' ' ' LEU . 79.6 t -117.06 116.08 50.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.096 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.67 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 56.4 m-85 -104.08 114.75 29.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.346 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.562 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.1 pt? -134.27 158.33 44.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.878 0.37 . . . . 10.0 111.445 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.585 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.8 mtm -125.94 117.03 22.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.418 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.4 mm -87.49 112.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -108.92 109.3 20.34 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -99.81 73.77 1.8 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.388 -1.338 . . . . 10.0 107.388 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.604 ' HB2' HG12 ' B' ' 90' ' ' ILE . 6.9 t-160 66.63 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.362 -0.835 . . . . 10.0 111.18 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -108.91 -24.55 11.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.947 0.404 . . . . 10.0 110.905 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.4 m -86.06 107.77 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.89 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -110.66 123.47 50.07 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.423 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.794 HG12 HD12 ' C' ' 12' ' ' ILE . 20.5 mt -118.72 122.19 68.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.758 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . 0.512 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 52.6 t80 -79.84 121.68 25.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.562 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.2 m -112.11 118.36 35.17 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 10.0 111.607 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.874 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.0 t70 -104.09 93.58 4.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.155 -1.054 . . . . 10.0 108.155 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.2 -167.95 1.36 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.479 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -127.58 166.37 18.16 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -62.61 -23.12 66.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.892 0.377 . . . . 10.0 111.6 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.98 -9.58 59.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.716 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 3.7 m -81.19 142.81 32.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.69 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 57.7 p -92.21 169.6 10.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.617 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.4 t -69.7 -34.9 63.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.089 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -63.57 -35.05 79.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.349 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -62.17 -36.14 80.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.764 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.671 HD11 HD21 ' B' ' 57' ' ' LEU . 84.6 mt -60.87 -45.36 94.86 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -60.46 -40.03 89.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.053 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -62.66 -41.08 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.572 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -66.79 -47.8 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.271 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -61.6 -36.53 73.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 10.0 110.53 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.721 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.2 OUTLIER -60.51 -36.41 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.029 179.451 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.98 -5.88 89.37 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 121.063 -0.589 . . . . 10.0 112.791 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 69.4 mt -107.48 -50.2 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.792 0.33 . . . . 10.0 110.81 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 30.5 mt -87.14 -9.58 54.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 10.0 111.767 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.03 50.15 12.58 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.503 0.502 . . . . 10.0 111.474 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.58 142.25 31.11 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.512 -179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.85 128.83 16.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.498 2.799 . . . . 10.0 113.102 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.721 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 60.0 Cg_endo -71.86 -24.94 20.56 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 123.027 2.485 . . . . 10.0 112.743 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 t0 -68.99 -23.05 64.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.933 0.397 . . . . 10.0 111.038 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -90.7 -2.99 57.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.592 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -88.85 135.8 33.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.955 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.518 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 60.3 mmt-85 -125.46 110.81 14.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.217 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 90.4 mt -91.79 120.79 32.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.881 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -114.36 118.69 34.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.081 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.471 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 47.4 tttm -123.06 130.56 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.901 -0.777 . . . . 10.0 108.901 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 61.23 33.76 19.02 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.068 0.461 . . . . 10.0 110.242 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 65.55 21.89 11.76 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.477 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -130.78 149.15 52.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.781 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.471 HD11 ' HD2' ' B' ' 43' ' ' ARG . 48.1 tp -78.13 131.42 37.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.733 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -80.15 150.76 30.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.504 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.71 124.37 39.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.817 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.22 -33.6 65.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.41 -22.49 67.4 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.821 -0.704 . . . . 10.0 113.81 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.11 157.77 23.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.245 0.545 . . . . 10.0 111.796 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 26.3 p -94.19 167.49 11.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.467 178.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.671 HD21 HD11 ' B' ' 27' ' ' LEU . 43.9 mt -59.08 -43.16 91.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.764 0.316 . . . . 10.0 111.724 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.52 -35.44 72.79 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.952 -0.642 . . . . 10.0 113.061 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -79.4 -17.83 53.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.809 0.337 . . . . 10.0 111.298 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.3 m -90.47 6.57 42.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.649 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.22 16.64 53.12 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.565 -0.826 . . . . 10.0 112.716 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 44.3 m-85 -92.04 90.31 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.837 0.351 . . . . 10.0 110.145 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 39.4 p -116.02 176.83 4.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' B' ' 68' ' ' ARG . 0.7 OUTLIER -69.99 -0.13 6.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 10.0 111.592 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -95.0 -51.14 4.79 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.861 0.362 . . . . 10.0 110.241 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.99 -25.46 43.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.931 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.67 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -119.25 95.88 4.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.135 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' B' ' 64' ' ' SER . 26.9 mtm180 -119.0 156.79 51.85 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.767 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.401 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 31.9 Cg_endo -65.32 -15.14 48.61 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.419 2.079 . . . . 10.0 111.228 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.45 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -101.39 -7.48 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.605 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.647 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.84 92.08 1.56 Allowed Pre-proline 0 C--O 1.235 0.297 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.675 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.585 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.7 Cg_exo -80.56 130.28 7.79 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.904 2.403 . . . . 10.0 111.376 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.55 127.29 30.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.626 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m -85.78 127.18 34.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.056 0.455 . . . . 10.0 111.617 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.2 t -121.74 133.24 68.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.382 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.04 137.64 17.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.775 -0.726 . . . . 10.0 111.577 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 tp -116.89 109.63 17.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.071 0.463 . . . . 10.0 111.887 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.69 151.7 20.44 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -128.37 123.37 33.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.746 0.307 . . . . 10.0 110.808 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -74.64 89.18 2.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.177 0.513 . . . . 10.0 111.191 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -119.78 129.87 54.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.588 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.04 137.62 49.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.038 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 69.5 13.21 8.33 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.596 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.6 m -116.92 96.21 5.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.621 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.23 -8.83 57.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.708 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.459 ' O ' HG13 ' B' ' 90' ' ' ILE . 33.4 tt0 -60.11 -31.56 70.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.451 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.32 88.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.161 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.43 -21.6 64.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 16.2 m -84.04 -18.14 38.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.111 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.604 HG12 ' HB2' ' B' ' 10' ' ' HIS . 43.4 mt -91.48 -29.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.856 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.58 116.06 23.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.217 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.452 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.79 -14.36 44.24 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.004 2.469 . . . . 10.0 111.953 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -91.86 -15.61 27.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 10.9 m -103.17 -30.94 10.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.885 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 69.2 m -148.68 147.1 23.74 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.6 138.78 50.88 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.311 2.008 . . . . 10.0 111.282 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.92 125.42 8.25 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.217 2.611 . . . . 10.0 111.75 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -56.09 113.46 1.54 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.634 -0.712 . . . . 10.0 111.873 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.2 tp -143.87 125.41 8.16 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.419 -0.809 . . . . 10.0 109.279 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 24.9 Cg_exo -64.83 123.72 12.07 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.8 2.333 . . . . 10.0 111.997 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -63.21 -30.28 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.176 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -66.77 -14.01 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.297 0.57 . . . . 10.0 110.116 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 78.4 mmm -123.08 34.8 5.03 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.606 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 30.3 tttm -105.6 -49.1 0.12 Allowed Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 113.029 0.752 . . . . 10.0 113.029 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.606 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 70.1 Cg_endo -73.67 63.02 4.71 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.0 1.8 . . . . 10.0 112.688 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.531 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 39.1 mt-30 -133.6 150.31 51.61 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.092 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.74 148.98 45.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.584 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.8 m -76.17 141.52 41.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.979 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -84.88 -144.15 6.66 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.52 -37.04 12.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.119 0.485 . . . . 10.0 110.658 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.647 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 66.4 m -80.65 161.94 24.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.671 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.83 126.68 28.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.016 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 66.06 14.71 9.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.064 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 31.3 tt0 -76.43 136.2 39.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.799 0.333 . . . . 10.0 110.176 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -115.37 144.41 43.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.812 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -130.33 113.15 14.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.007 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.531 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -76.39 126.33 36.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.44 -0.346 . . . . 10.0 110.392 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.474 -0.33 . . . . 10.0 111.534 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.065 0.46 . . . . 10.0 111.321 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.559 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -118.07 115.93 25.84 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.766 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.6 mt -87.8 124.33 33.51 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.774 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 15.4 mt -107.61 113.07 42.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -83.82 166.26 18.1 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.653 -0.249 . . . . 10.0 111.019 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -68.69 -10.52 56.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.493 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -84.48 -11.84 55.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.157 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.98 28.46 20.83 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.147 -0.781 . . . . 10.0 111.147 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -106.46 133.09 51.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.171 -0.307 . . . . 10.0 110.171 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.559 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 25.2 mt-10 -98.2 129.82 44.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.354 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -123.23 101.12 7.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.68 0.276 . . . . 10.0 110.634 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.794 HD12 HG12 ' B' ' 14' ' ' ILE . 45.3 mt -94.06 125.62 46.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 4.5 t -107.64 148.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.904 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.874 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 58.2 tttt -59.56 138.18 57.78 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.119 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -51.56 -43.73 62.49 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.277 0.473 . . . . 10.0 112.277 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.569 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.5 tt0 -56.84 -52.17 66.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.396 . . . . 10.0 111.51 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -65.79 -41.29 92.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.775 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.87 96.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.398 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 65.7 mt -62.6 -48.24 80.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.71 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 8.7 m -60.74 -41.16 94.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 36.4 m -67.59 -31.72 71.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.429 . . . . 10.0 110.561 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.79 -9.84 83.2 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.932 -0.651 . . . . 10.0 112.151 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -84.03 -17.97 38.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.055 0.455 . . . . 10.0 110.109 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.8 mt -80.3 157.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.674 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -73.34 78.1 1.36 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.201 0.524 . . . . 10.0 110.524 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.575 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -94.58 170.75 9.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.458 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.489 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 92.2 mmm -78.34 31.41 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.249 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mp -68.59 -26.12 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.158 0.504 . . . . 10.0 110.503 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 7.6 m -95.71 15.73 19.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.199 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.0 -61.31 3.8 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.378 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.82 166.61 15.6 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.713 2.275 . . . . 10.0 111.464 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.03 -66.64 2.71 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.31 -0.471 . . . . 10.0 113.551 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -126.05 120.9 31.45 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 122.39 -0.476 . . . . 10.0 111.415 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -95.65 90.96 5.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.35 166.6 22.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.702 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -63.8 -33.97 76.86 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -63.53 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.759 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.461 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.1 mp0 -72.69 -24.0 60.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.432 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -80.3 -19.26 47.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.26 0.552 . . . . 10.0 109.929 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -94.09 -59.95 1.85 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.979 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -105.83 89.18 3.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.087 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.461 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.4 t -84.89 94.66 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.109 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . 0.403 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 21.0 t-20 -82.18 119.12 23.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.049 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -104.56 124.16 48.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.545 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -105.08 140.5 38.16 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.934 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 69.52 19.78 7.37 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.878 0.736 . . . . 10.0 111.011 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -127.04 107.5 21.92 Favored Pre-proline 0 C--O 1.236 0.389 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.98 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.506 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 27.5 Cg_exo -64.97 158.75 49.82 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 123.269 2.646 . . . . 10.0 112.13 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -67.37 -41.52 84.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.266 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -57.41 8.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.518 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.509 ' HB ' HD21 ' C' ' 85' ' ' LEU . 32.4 m -65.56 -35.25 74.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.674 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -66.66 -34.69 78.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -60.16 -42.92 95.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.73 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 46.8 tttp -65.9 -35.18 79.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.458 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.441 HG23 ' O ' ' C' ' 51' ' ' VAL . 66.8 t -65.41 -44.57 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.736 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 54.8 m -61.18 -42.65 98.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.687 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.4 mtm -66.63 -38.91 87.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.726 179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.579 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.9 t80 -62.09 -43.84 97.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.587 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.3 m-85 -65.13 -43.35 92.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.262 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 75.3 m -57.85 -43.78 86.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.415 0.626 . . . . 10.0 109.584 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' B' ' 70' ' ' GLN . 14.0 t80 -67.07 -42.8 84.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.133 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -59.97 -39.12 84.53 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.232 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.421 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -59.4 -50.08 81.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.004 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.1 mmt180 -71.96 -37.24 69.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.653 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 83.3 t80 -59.03 -42.36 90.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.965 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.6 13.65 15.36 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.758 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -117.2 -56.34 2.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.331 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.12 -20.44 0.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.611 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 13.7 m -84.15 27.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.127 0.489 . . . . 10.0 111.512 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 -11.2 59.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.278 0.561 . . . . 10.0 110.128 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -77.42 -22.63 51.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.326 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.744 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 37.0 pt -100.37 165.88 13.63 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.031 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.744 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 58.6 Cg_endo -71.11 171.2 16.38 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.306 2.004 . . . . 10.0 113.241 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.64 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 5.9 tp10 -71.51 173.68 7.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.147 -0.933 . . . . 10.0 108.904 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.64 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 17.5 t80 -54.01 130.26 58.27 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 73.1 Cg_exo -51.71 131.79 38.95 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.135 2.557 . . . . 10.0 112.914 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.605 HG22 ' HA ' ' A' ' 16' ' ' LEU . 16.7 pt -84.14 37.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.915 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.439 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -90.18 -54.58 0.29 Allowed Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.55 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.439 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 34.6 Cg_endo -65.49 116.94 4.19 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.758 1.639 . . . . 10.0 111.681 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -69.58 -2.39 11.36 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.44 94.9 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.221 0.534 . . . . 10.0 110.452 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.502 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -161.51 -42.46 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.619 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.881 HD23 HD11 ' A' ' 22' ' ' ILE . 8.4 tp -68.43 -24.85 64.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.687 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 26.9 mp0 -63.27 -35.64 81.01 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.887 -1.051 . . . . 10.0 108.946 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.693 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -78.97 -34.36 44.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.264 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.421 HD13 HD12 ' C' ' 83' ' ' LEU . 5.4 tt -64.46 -30.23 71.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.221 -0.9 . . . . 10.0 110.034 179.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 29.0 ttp -62.53 -18.16 61.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.44 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.56 83.06 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.593 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.94 -51.67 0.53 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.453 0.908 . . . . 10.0 113.453 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -78.81 13.54 1.66 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.878 0.371 . . . . 10.0 111.49 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.876 0 CA-C-O 118.786 -0.626 . . . . 10.0 109.435 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 CA-C-O 120.196 -0.224 . . . . 10.0 112.916 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.58 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.18 -67.37 0.4 Allowed 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.871 0.323 . . . . 10.0 111.871 -179.374 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.631 HD23 ' HB3' ' C' ' 85' ' ' LEU . 9.4 mp -63.87 -34.79 78.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 10.0 110.392 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -52.45 -34.97 51.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.694 -0.685 . . . . 10.0 111.185 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -100.32 -40.77 7.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.566 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.505 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 79.7 mt -64.18 -39.86 94.88 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.064 0.765 . . . . 10.0 113.064 -178.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.31 -30.64 69.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.628 0.252 . . . . 10.0 111.382 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.4 -32.58 73.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.151 0.5 . . . . 10.0 110.192 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.65 56.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.553 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.04 -26.63 15.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.761 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.9 OUTLIER -164.93 118.99 1.29 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.644 179.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.3 mt -86.02 97.03 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.544 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 76.8 tttt -113.29 97.01 41.65 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.186 -178.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -88.22 59.14 2.88 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.854 2.369 . . . . 10.0 111.631 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.544 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 34.3 mttm -111.66 177.31 4.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.786 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -81.06 151.97 28.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.719 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.413 HD11 ' CD2' ' C' ' 83' ' ' LEU . 44.9 mm -116.05 110.79 32.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.143 0.497 . . . . 10.0 111.351 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -126.87 137.38 30.43 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.642 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 18.1 Cg_exo -32.7 137.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 124.27 3.313 . . . . 10.0 114.297 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.763 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.4 Cg_endo -58.87 131.13 40.17 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.056 2.504 . . . . 10.0 112.217 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' H ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -71.72 123.21 89.08 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.643 179.772 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 -9.2 21.76 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.995 2.463 . . . . 10.0 111.876 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -31.63 72.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.103 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 ' HG2' ' A' ' 30' ' ' ARG . 14.0 t -134.78 -100.06 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.609 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.1 ptp180 176.81 53.66 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.191 0.597 . . . . 10.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 tttm -149.52 149.19 30.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.45 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.763 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.4 159.6 33.72 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.931 0.396 . . . . 10.0 110.861 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -108.83 179.47 4.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.874 -179.202 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.424 ' H ' HG22 ' A' ' 33' ' ' THR . 41.5 mt-10 -124.6 130.2 51.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.84 0.352 . . . . 10.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.7 OUTLIER -168.37 -74.08 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.632 179.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.439 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.07 -56.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.851 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.621 -0.704 . . . . 10.0 110.261 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.7 tmm? . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 120.976 0.417 . . . . 10.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.0 143.29 31.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.346 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -127.49 118.31 49.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 120.992 0.425 . . . . 10.0 110.264 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.526 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 62.4 m-85 -105.37 113.09 26.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.45 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.541 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -128.38 156.99 42.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.809 0.338 . . . . 10.0 111.354 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.498 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 64.6 mtm -125.21 108.37 11.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.529 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.504 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.4 mm -81.33 104.34 9.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.419 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -100.49 102.04 13.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.522 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 29.7 ttp85 -89.25 65.8 7.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.535 ' HB2' HG12 ' B' ' 90' ' ' ILE . 9.1 t-160 68.73 -77.94 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.145 -0.934 . . . . 10.0 110.645 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -108.54 -15.81 14.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.986 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -97.56 99.35 10.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.243 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -98.17 113.68 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.738 0.304 . . . . 10.0 110.561 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.5 mt -108.36 119.2 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.909 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . 0.526 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 76.1 t80 -80.66 124.24 28.84 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.815 -0.439 . . . . 10.0 109.815 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.541 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -117.93 122.28 42.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.041 0.448 . . . . 10.0 112.093 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.861 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.7 t70 -104.47 99.25 8.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.818 -1.178 . . . . 10.0 107.818 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.55 -167.89 1.6 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.844 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -123.45 160.39 27.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.22 -26.72 67.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.956 0.408 . . . . 10.0 111.954 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.89 -10.75 59.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.983 -0.553 . . . . 10.0 112.062 -179.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 17.8 m -72.86 143.16 47.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 10.7 p -90.37 157.91 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.722 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -60.72 -36.75 73.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 10.0 111.165 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.9 -30.59 70.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.833 179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.18 -36.76 85.22 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.27 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.51 HD11 HD21 ' B' ' 57' ' ' LEU . 78.3 mt -61.23 -43.08 99.46 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.534 -0.543 . . . . 10.0 109.534 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -61.71 -38.52 88.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.168 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 61.9 mtp180 -65.87 -39.49 90.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.818 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 99.0 mt -65.96 -46.31 88.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.58 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 70.0 t -62.15 -38.1 80.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.753 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.816 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 2.2 tm-20 -61.54 -37.1 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.08 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.02 -4.35 77.53 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 120.972 -0.633 . . . . 10.0 112.895 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 84.4 mt -112.68 -54.03 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.725 0.298 . . . . 10.0 111.23 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.9 mt -82.39 -14.66 54.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.239 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 63.4 mttt 58.0 48.68 12.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.757 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -137.27 139.98 29.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.328 -0.851 . . . . 10.0 110.072 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -43.85 123.87 4.24 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.923 3.082 . . . . 10.0 113.665 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . 0.816 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.5 Cg_endo -71.4 -16.53 31.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.924 2.416 . . . . 10.0 111.848 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.69 -38.48 85.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.216 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.468 ' HA ' ' NH2' ' B' ' 43' ' ' ARG . 7.8 mm-40 -96.61 14.18 25.69 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -178.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.89 127.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.489 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 26.1 mmt-85 -112.95 108.23 17.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.567 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.3 mt -90.71 112.37 24.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.087 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' B' ' 93' ' ' PHE . 35.1 m-85 -108.06 117.38 34.0 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.546 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.7 tttm -132.23 138.33 47.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.301 -1.0 . . . . 10.0 108.301 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 63.39 27.98 15.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.446 0.466 . . . . 10.0 109.871 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 67.12 17.24 10.38 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.464 -0.789 . . . . 10.0 111.613 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -129.49 166.11 20.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.9 tp -89.91 130.54 36.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.577 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' B' ' 46' ' ' LYS . 82.9 mt -72.71 158.2 36.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.226 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.493 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 18.0 t0 -100.54 127.15 46.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.956 -179.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -66.24 -28.2 68.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.597 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.1 8.18 79.94 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.109 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 97.5 mttt -116.79 159.71 21.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.865 0.364 . . . . 10.0 110.817 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.2 p -92.06 170.47 9.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.613 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.536 ' O ' ' HB2' ' B' ' 62' ' ' PHE . 26.3 mt -62.72 -42.45 99.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.79 -33.8 69.06 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.165 -0.54 . . . . 10.0 112.589 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -80.03 -13.64 59.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.678 0.275 . . . . 10.0 111.572 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 59.9 m -99.62 16.27 23.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.949 0.404 . . . . 10.0 111.633 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.17 11.85 77.62 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.728 -0.748 . . . . 10.0 113.199 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 29.9 m-85 -86.84 96.86 10.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 117.061 0.431 . . . . 10.0 110.186 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 156.83 31.89 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 50.7 m -60.86 -22.28 64.1 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.183 0.438 . . . . 10.0 112.183 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -76.43 -37.36 57.14 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.812 0.301 . . . . 10.0 111.812 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -39.32 18.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.196 0.522 . . . . 10.0 109.674 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.56 82.1 1.99 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.283 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -89.67 157.76 46.22 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.029 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.28 -21.24 71.17 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.609 2.206 . . . . 10.0 111.819 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CG ' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.67 4.05 23.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.794 179.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.569 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -155.83 80.23 4.05 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.613 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.498 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.7 Cg_exo -74.7 144.83 31.92 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.889 2.392 . . . . 10.0 111.99 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 120.74 19.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.816 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.46 120.93 21.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.465 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.504 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.0 t -118.77 133.84 64.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.19 137.64 14.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.626 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.81 107.93 14.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.969 0.414 . . . . 10.0 111.578 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.489 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -103.55 138.83 39.7 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.183 -0.673 . . . . 10.0 109.183 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -114.79 121.75 44.25 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -74.57 82.87 2.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 10.0 111.849 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.21 122.32 43.97 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -66.01 145.88 55.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.338 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.93 24.79 14.74 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.875 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.3 m -132.09 112.34 12.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.207 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -69.82 -19.1 63.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.052 0.453 . . . . 10.0 111.198 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.8 tt0 -54.64 -33.2 60.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.217 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.55 -30.26 69.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.769 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 14.0 mt -92.18 -9.92 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.316 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 43.0 m -87.23 -35.62 18.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.917 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.535 HG12 ' HB2' ' B' ' 10' ' ' HIS . 3.6 mt -89.54 14.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.234 0.54 . . . . 10.0 110.825 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.94 103.85 46.41 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.548 ' HA ' ' O ' ' B' ' 95' ' ' SER . 18.8 Cg_exo -67.97 -3.86 11.36 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.338 2.692 . . . . 10.0 112.054 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.422 ' HB2' ' CE1' ' B' ' 45' ' ' TYR . 39.5 t80 -75.65 -27.62 58.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.998 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 68.7 m -124.31 -35.56 2.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.239 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.548 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 58.8 m -103.42 151.54 38.65 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.419 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.49 157.84 32.56 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.553 2.169 . . . . 10.0 111.441 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 132.87 31.43 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.268 1.979 . . . . 10.0 111.4 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -68.67 108.97 3.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.069 0.462 . . . . 10.0 111.424 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 19.2 tp -138.57 125.43 13.05 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.35 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.3 Cg_exo -60.75 135.01 57.25 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.81 2.34 . . . . 10.0 112.698 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.34 -38.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.971 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 m -68.24 -18.2 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.236 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.455 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.8 mmm -115.45 51.03 0.95 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.468 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.567 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 60.7 tttm -119.38 -53.87 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -179.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.567 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.8 Cg_exo -76.77 67.62 7.32 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.499 2.133 . . . . 10.0 111.903 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.577 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 56.0 mt-30 -133.4 162.15 32.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.517 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.499 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.8 t0 -79.91 178.03 8.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.021 0.438 . . . . 10.0 111.356 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.88 131.13 43.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.25 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.68 -153.37 15.46 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.95 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.36 -29.77 17.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.098 0.475 . . . . 10.0 110.739 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.4 m -93.74 159.68 15.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.83 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . 0.569 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -69.85 134.22 48.24 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.347 -0.982 . . . . 10.0 108.347 178.303 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.03 -5.96 2.08 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.566 0.541 . . . . 10.0 111.46 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.1 tt0 -74.16 127.34 32.7 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.845 0.355 . . . . 10.0 110.466 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -109.69 139.8 44.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . 0.499 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -99.62 101.93 13.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.361 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.577 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -70.5 109.24 2.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.101 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.445 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.699 0.285 . . . . 10.0 110.985 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -101.68 105.43 16.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.641 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 36.5 mt -91.1 113.44 25.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.808 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 33.3 mt -100.6 119.4 48.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -93.09 166.24 12.44 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.673 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -16.97 44.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -85.67 -3.77 58.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.799 0.333 . . . . 10.0 110.729 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.59 18.28 60.45 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.584 -0.817 . . . . 10.0 112.713 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 135.9 33.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -104.65 113.23 26.67 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.999 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.641 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 97.4 m-85 -102.87 113.02 26.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.692 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 22.3 mm -98.82 117.91 44.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -103.83 137.97 30.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.544 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.861 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 74.5 tttt -60.02 134.44 57.05 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -51.69 -43.6 62.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.854 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -51.89 -51.61 55.6 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.96 0.41 . . . . 10.0 111.744 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -74.22 -37.28 63.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.332 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.63 95.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.479 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.74 -49.6 77.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.815 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.407 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.1 m -63.15 -36.61 84.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.981 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.2 m -67.16 -33.14 74.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 10.0 110.407 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.1 -11.69 84.65 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.398 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 -18.26 47.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 10.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -83.75 160.53 3.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.394 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -73.74 86.43 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.136 0.493 . . . . 10.0 111.059 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.24 173.44 6.79 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.829 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.724 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 90.0 mmm -78.58 31.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.873 0.323 . . . . 10.0 111.873 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 tp -65.25 -31.99 73.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.568 . . . . 10.0 109.809 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.5 14.19 19.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.466 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.6 -60.29 5.51 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.865 -0.607 . . . . 10.0 113.185 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.91 179.76 2.56 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.345 2.03 . . . . 10.0 112.461 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.21 -55.44 18.7 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.289 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -142.13 121.29 12.99 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.784 -0.245 . . . . 10.0 110.824 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.91 91.24 5.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.6 159.83 26.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.047 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -60.58 -25.37 66.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.497 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.2 -35.1 71.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.073 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.05 -28.77 64.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.388 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.02 -16.11 60.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -85.12 -52.38 5.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.385 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -129.56 99.06 5.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.376 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -83.52 114.72 24.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.628 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -90.33 109.11 20.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.869 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -106.76 94.47 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 10.0 111.374 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 86.8 mtt180 -89.89 156.71 18.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 12.2 mm-40 70.95 16.6 6.47 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.234 0.54 . . . . 10.0 111.305 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 75.8 mt -130.15 117.94 18.19 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.708 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.574 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 24.6 Cg_exo -65.55 138.83 56.13 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.791 2.327 . . . . 10.0 111.806 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -59.95 -40.85 90.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -50.04 61.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.902 -0.59 . . . . 10.0 112.392 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.0 m -73.87 -27.4 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 120.942 -0.303 . . . . 10.0 111.593 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.86 -39.36 93.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.512 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -35.34 72.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.86 0.362 . . . . 10.0 110.791 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.14 -35.11 77.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.116 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.0 t -67.24 -47.44 81.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 35.9 m -59.56 -40.53 87.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.462 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -65.69 -42.51 91.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.849 179.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.505 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 71.6 t80 -65.44 -40.58 93.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.817 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.404 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.3 m-30 -61.7 -47.34 85.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.925 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.5 m -60.58 -42.21 96.23 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.972 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CG ' ' HB3' ' B' ' 70' ' ' GLN . 21.2 t80 -62.86 -42.53 99.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.325 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -64.13 -37.54 87.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.167 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.407 HG22 ' HB ' ' C' ' 20' ' ' THR . 54.2 t -61.82 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.006 0.431 . . . . 10.0 110.089 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.2 mmt180 -72.79 -42.31 64.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.185 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.494 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 88.7 t80 -57.25 -48.44 78.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 50.06 1.7 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.208 0.528 . . . . 10.0 110.771 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -162.16 -58.44 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.297 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -130.1 -36.92 1.5 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.981 0.42 . . . . 10.0 111.647 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.494 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 11.2 m -83.9 37.22 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.68 8.09 23.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.5 0.667 . . . . 10.0 109.694 179.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -99.52 -2.34 36.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.523 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.71 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 42.1 pt -115.91 166.54 12.09 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.71 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 73.4 Cg_endo -75.57 172.36 16.47 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.371 2.047 . . . . 10.0 112.718 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.56 170.32 9.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.036 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 57.2 t80 -53.94 130.63 57.96 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.766 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 52.8 Cg_exo -54.07 118.62 5.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.994 2.463 . . . . 10.0 112.197 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' ' 16' ' ' LEU . 22.9 pt -81.18 42.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.657 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -89.32 -59.47 0.25 Allowed Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 58.0 Cg_endo -72.09 111.16 3.11 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.707 1.604 . . . . 10.0 111.365 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.549 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.52 56.37 2.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.681 -178.84 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 3.9 mm -120.08 9.8 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.465 0.65 . . . . 10.0 110.549 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -88.28 -26.03 22.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.095 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.472 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 tp -70.87 -27.58 63.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.069 0.461 . . . . 10.0 109.816 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.471 ' HA ' HD23 ' A' ' 32' ' ' LEU . 15.0 mp0 -61.39 -31.65 71.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.668 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.631 ' HB3' HD23 ' A' ' 8' ' ' LEU . 27.5 mt -77.5 -35.99 53.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.349 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.2 -23.81 65.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.579 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . 0.443 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 38.6 ttp -57.49 -26.95 62.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.27 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.59 -30.85 71.64 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.57 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.87 -65.54 0.28 Allowed 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -82.9 36.56 0.5 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.352 0.501 . . . . 10.0 112.352 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.724 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 12.2 m-85 . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.128 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.685 -0.166 . . . . 10.0 112.685 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -63.74 1.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -179.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' C' ' 85' ' ' LEU . 11.1 tp -62.74 -27.93 69.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.501 -179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.546 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 5.7 mt-30 -58.98 -26.86 64.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.349 0.595 . . . . 10.0 110.765 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -105.01 -38.73 6.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.199 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.515 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 85.8 mt -62.86 -38.8 92.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.406 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.33 84.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.682 0.277 . . . . 10.0 110.802 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 tp -67.49 -27.73 67.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.366 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.02 -17.98 44.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.157 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.8 -48.83 6.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.603 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HA ' HG22 ' C' ' 77' ' ' ILE . 1.4 tp -149.8 124.63 9.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.407 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -95.73 93.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.112 -0.699 . . . . 10.0 109.112 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.425 ' CD ' ' HB2' ' C' ' 80' ' ' GLU . 28.1 ttpt -98.01 116.75 65.61 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.226 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -90.83 38.18 0.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.951 2.434 . . . . 10.0 111.972 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.421 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 57.2 mttm -94.95 166.58 11.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.237 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -79.03 154.84 29.15 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.597 HD11 HD23 ' C' ' 83' ' ' LEU . 47.3 mm -118.41 105.93 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.06 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 39.5 tttp -122.75 143.46 40.25 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 23' ' ' LYS . 33.0 Cg_exo -29.6 130.07 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 124.557 3.505 . . . . 10.0 114.326 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.712 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.34 135.4 67.73 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.393 2.729 . . . . 10.0 113.026 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -74.66 128.33 85.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.839 179.794 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -68.95 -13.62 37.02 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.099 2.533 . . . . 10.0 112.986 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.06 -35.67 80.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.974 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -129.78 -122.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.995 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -160.2 58.09 0.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.19 0.519 . . . . 10.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.43 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.8 tttm -152.31 154.56 35.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.682 -0.69 . . . . 10.0 109.256 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.712 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -77.69 152.78 33.57 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.744 0.306 . . . . 10.0 110.536 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.552 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 2.5 m -87.34 149.22 24.65 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.231 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -105.11 99.71 9.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.851 0.358 . . . . 10.0 110.285 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.6 t70 -149.78 -74.76 0.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.148 -0.478 . . . . 10.0 109.959 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.69 -68.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 179.002 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.3 m0 . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.255 179.342 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.412 ' HA ' ' OE2' ' B' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.051 0.453 . . . . 10.0 110.334 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.51 132.36 35.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.707 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . 0.419 HG11 HD13 ' B' ' 57' ' ' LEU . 57.5 t -121.4 116.57 50.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.707 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.562 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.8 m-85 -107.35 113.24 26.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.759 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -128.01 158.4 38.0 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.866 0.365 . . . . 10.0 111.323 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.614 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 57.3 mtm -128.51 109.25 11.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.642 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.479 HD13 ' HB ' ' B' ' 75' ' ' VAL . 40.9 mm -83.51 110.14 17.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -107.86 108.1 19.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -91.69 71.48 5.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.593 -1.262 . . . . 10.0 107.593 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.574 ' HB2' HG12 ' B' ' 90' ' ' ILE . 8.5 t-160 67.19 -77.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.482 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 73.3 mmtt -110.27 -7.61 14.82 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -106.36 104.49 14.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.519 0.2 . . . . 10.0 111.394 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.5 m -101.04 118.08 36.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.783 0.325 . . . . 10.0 110.568 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.525 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.8 mt -110.86 123.85 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.743 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . 0.529 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 86.6 t80 -81.08 125.17 29.87 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.759 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -118.07 119.2 34.03 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.161 0.505 . . . . 10.0 111.6 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -104.91 101.55 11.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.318 -0.993 . . . . 10.0 108.318 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.72 -171.2 2.32 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.89 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -124.35 162.41 23.86 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.412 ' OE2' ' HA ' ' B' ' 1' ' ' MET . 56.2 mt-10 -61.11 -22.94 65.13 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.345 0.498 . . . . 10.0 112.345 -179.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -2.07 47.04 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -91.88 144.54 25.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.531 0.205 . . . . 10.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 32.3 p -93.31 167.31 11.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.078 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.593 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.5 t -66.3 -34.54 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.865 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -62.14 -36.37 81.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 10.0 110.357 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.66 -33.2 75.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.835 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.958 HD11 HD21 ' B' ' 57' ' ' LEU . 69.7 mt -63.39 -45.95 88.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 10.0 109.928 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.52 -32.54 73.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.529 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -64.79 -37.46 87.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.037 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -69.01 -44.48 81.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.44 -33.64 57.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.482 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . 0.544 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 29.7 tt0 -59.8 -34.22 72.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.96 -0.563 . . . . 10.0 111.058 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.7 -19.29 58.39 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.542 -0.837 . . . . 10.0 112.844 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.7 mt -89.24 -57.91 3.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 10.0 111.66 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 39.8 mt -91.86 -8.12 47.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.854 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 85.1 mttt 58.78 51.2 7.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.368 0.604 . . . . 10.0 110.817 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 25.5 mmt180 -125.02 133.65 25.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.052 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.37 125.57 19.25 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.928 2.418 . . . . 10.0 112.294 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.69 -21.84 73.04 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.225 2.616 . . . . 10.0 113.059 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -64.39 -33.23 75.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.1 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 12.7 mm-40 -94.14 -2.77 52.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.059 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -82.64 126.85 32.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.54 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 86.7 mmt-85 -120.02 110.86 17.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' B' ' 51' ' ' LEU . 54.0 mt -92.86 118.08 30.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.905 0.383 . . . . 10.0 111.062 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -112.98 117.57 32.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.724 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.504 ' HB3' HD21 ' B' ' 51' ' ' LEU . 14.4 tmtt? -128.99 137.69 51.5 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.317 -0.994 . . . . 10.0 108.317 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 66.28 27.25 10.21 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.514 0.509 . . . . 10.0 109.749 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 67.89 17.07 9.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.773 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -132.12 169.79 15.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 41.7 tp -85.24 135.07 34.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.955 0.407 . . . . 10.0 111.202 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' B' ' 46' ' ' LYS . 65.2 mt -79.0 150.23 32.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.532 179.325 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 14.7 t0 -92.19 113.64 25.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.0 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.593 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.4 m-20 -58.02 -28.01 64.08 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.651 0.611 . . . . 10.0 112.651 -179.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.64 -11.62 68.16 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.425 -178.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 59.4 mttp -95.29 153.74 17.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.968 0.413 . . . . 10.0 110.796 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 32.6 p -83.37 165.54 19.18 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.23 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.958 HD21 HD11 ' B' ' 27' ' ' LEU . 74.4 mt -58.35 -44.73 88.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.16 -33.07 64.04 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.451 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.57 -29.57 52.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.946 0.403 . . . . 10.0 111.086 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . 0.494 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 36.9 m -83.58 14.37 3.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 111.696 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 81.66 12.35 81.72 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 121.081 -0.581 . . . . 10.0 112.905 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.494 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 61.3 m-85 -87.79 85.7 7.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.003 0.43 . . . . 10.0 110.321 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 47.1 p -114.42 165.23 12.95 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.435 -0.58 . . . . 10.0 109.435 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 9.7 m -65.54 -5.15 7.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.897 0.379 . . . . 10.0 111.971 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -81.8 -46.35 14.31 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.233 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.31 -35.14 18.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.937 179.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.562 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -101.35 93.31 5.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.275 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -109.43 157.84 36.23 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.666 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.61 -17.17 58.7 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.402 2.068 . . . . 10.0 111.518 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.13 -5.76 21.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.507 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -157.54 89.48 2.44 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.723 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.614 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 4.6 Cg_exo -79.14 138.29 14.19 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.966 2.444 . . . . 10.0 111.941 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.67 117.45 8.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.533 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -80.1 125.59 30.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.086 0.47 . . . . 10.0 111.672 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.479 ' HB ' HD13 ' B' ' 7' ' ' ILE . 32.0 t -119.3 139.27 47.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.456 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.18 131.25 10.54 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.582 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.439 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 52.0 tp -109.64 99.36 8.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.873 0.368 . . . . 10.0 111.321 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.452 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.51 113.42 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 80.3 t80 -96.05 117.35 30.5 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.64 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -71.87 91.57 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.224 0.535 . . . . 10.0 111.221 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -99.64 129.96 45.83 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.19 129.88 41.7 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.38 19.86 11.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.624 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 2.0 m -117.08 112.96 21.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.853 0.359 . . . . 10.0 110.127 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -74.09 -6.37 47.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.127 0.788 . . . . 10.0 113.127 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.4 tt0 -62.91 -32.6 73.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.935 0.398 . . . . 10.0 111.341 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.95 -37.45 74.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.89 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.25 -15.27 61.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.928 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.92 -26.06 17.77 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.574 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.7 mt -84.11 -11.82 11.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 10.0 110.982 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -85.67 113.36 50.74 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.847 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.4 Cg_exo -66.68 -14.94 45.91 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.047 2.498 . . . . 10.0 111.827 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -74.0 -37.38 64.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.262 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -96.67 -44.86 6.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.817 0.341 . . . . 10.0 111.021 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.9 m -111.45 138.98 21.57 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.657 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.04 153.75 76.77 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.386 2.057 . . . . 10.0 111.519 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -52.51 126.85 22.07 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.036 2.491 . . . . 10.0 112.575 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -70.31 107.29 3.69 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.259 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 24.0 tp -138.77 126.74 13.64 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.91 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.9 Cg_exo -60.13 127.01 21.74 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.589 2.193 . . . . 10.0 111.778 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.66 -31.26 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.735 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 20.7 m -67.5 -14.67 18.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.683 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.5 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 79.9 mmm -114.51 10.69 16.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.129 0.49 . . . . 10.0 109.873 179.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 25.4 ttpt -78.27 -53.42 1.35 Allowed Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 112.834 0.679 . . . . 10.0 112.834 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.9 Cg_exo -76.93 71.43 6.2 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.474 2.116 . . . . 10.0 112.356 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.529 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 53.6 mt-30 -135.73 167.73 20.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.0 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.62 159.3 19.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.944 0.402 . . . . 10.0 111.735 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -82.82 138.22 34.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -93.64 -174.7 39.97 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 121.085 -0.578 . . . . 10.0 112.312 179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -33.18 67.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.992 0.425 . . . . 10.0 111.546 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.653 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.0 OUTLIER -85.25 159.55 20.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.166 -179.363 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.56 121.73 15.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.332 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.28 13.53 6.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.921 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.571 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.2 tt0 -73.36 128.66 36.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -106.4 130.42 54.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.799 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.97 107.81 16.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.352 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.529 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -72.05 126.7 33.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.085 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.3 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.022 0.439 . . . . 10.0 110.775 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . 0.596 ' HD3' ' HG2' ' C' ' 41' ' ' GLU . 85.0 tttt -110.57 119.0 37.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.742 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.468 HD22 ' HE2' ' C' ' 44' ' ' PHE . 43.2 mt -99.92 129.83 46.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.058 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 37.4 mt -113.5 119.91 62.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.7 p -89.64 168.36 12.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.178 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -69.15 -16.57 63.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.825 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -81.05 -16.71 52.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.94 0.4 . . . . 10.0 110.542 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 98.7 13.25 41.32 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.409 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -90.82 130.37 36.79 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.821 -0.436 . . . . 10.0 109.821 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -98.7 134.3 41.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.106 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -124.31 123.25 39.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.675 0.274 . . . . 10.0 111.29 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.525 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 33.2 mm -102.14 114.56 41.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 t -97.63 141.43 15.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.414 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -61.8 121.97 14.2 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.42 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 37.5 ttt-85 -51.36 -39.91 58.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.764 0.653 . . . . 10.0 112.764 -178.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -58.37 -52.37 65.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.809 0.337 . . . . 10.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -68.46 -33.01 73.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.091 0.472 . . . . 10.0 110.49 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.82 88.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.688 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 85.2 mt -61.67 -45.28 94.7 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.883 -0.414 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.45 -38.64 91.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.975 178.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -65.53 -36.78 84.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.286 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.72 -8.49 81.77 Favored Glycine 0 C--N 1.33 0.209 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.334 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 18.7 m -81.36 -20.96 39.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.393 0.616 . . . . 10.0 109.578 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.7 mt -84.06 159.03 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.175 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -76.11 81.19 2.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.143 0.497 . . . . 10.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.28 -163.19 0.85 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.876 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 83.9 mmm -101.76 27.39 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.64 -0.254 . . . . 10.0 111.453 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.91 -36.45 84.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.265 0.555 . . . . 10.0 110.495 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.2 m -91.58 14.32 15.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.397 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -57.75 4.94 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-N 115.823 -0.626 . . . . 10.0 113.16 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.44 -160.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.686 2.258 . . . . 10.0 111.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.37 -110.64 0.16 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.78 -0.724 . . . . 10.0 112.285 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -86.69 123.97 32.44 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 122.753 -0.263 . . . . 10.0 110.612 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -101.25 74.99 1.6 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.005 0.431 . . . . 10.0 110.105 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.15 158.44 33.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.335 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.03 -27.77 63.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.03 -35.82 77.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.02 0.438 . . . . 10.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -84.87 -21.7 29.66 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.74 -0.663 . . . . 10.0 109.824 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.1 m -77.72 -40.11 42.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.517 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -68.0 -47.31 68.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.862 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.596 ' HG2' ' HD3' ' C' ' 2' ' ' LYS . 37.1 mt-10 -124.82 90.43 3.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.18 115.63 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.886 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -91.98 111.96 23.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.917 0.389 . . . . 10.0 110.804 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.468 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.8 m-85 -97.36 114.85 26.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.112 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' C' ' 45' ' ' ARG . 39.3 mtt180 -100.11 147.13 26.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.221 -0.445 . . . . 10.0 109.887 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 65.52 21.41 11.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.749 0.655 . . . . 10.0 110.839 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 90.0 mt -129.59 109.49 17.42 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-O 121.079 0.466 . . . . 10.0 111.131 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 38.1 Cg_exo -63.77 150.98 87.17 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.135 2.557 . . . . 10.0 112.13 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.2 p -64.99 -38.96 92.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.411 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -54.24 46.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.78 -0.645 . . . . 10.0 112.294 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . 0.443 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.3 m -67.81 -34.62 68.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.638 -0.255 . . . . 10.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.53 -37.93 89.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.62 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . 0.433 ' O ' ' HG3' ' C' ' 57' ' ' MET . 40.8 m -58.05 -40.71 81.62 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.543 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -67.55 -35.59 79.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.567 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.4 t -64.26 -46.49 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.847 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.4 m -60.66 -39.49 88.58 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.158 -0.473 . . . . 10.0 110.628 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' C' ' 53' ' ' SER . 52.6 mtm -67.29 -41.45 85.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.334 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.515 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -62.11 -42.87 99.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.49 179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.4 m-85 -61.49 -47.2 86.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.266 179.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -61.06 -42.45 98.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.161 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.18 -44.82 90.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.078 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 tptt -59.93 -42.14 93.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.612 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 51.3 t -59.12 -50.94 77.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.313 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' C' ' 64' ' ' ARG . 9.5 mmt85 -66.9 -42.33 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.733 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.8 -43.75 85.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.231 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 15.88 14.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.115 0.484 . . . . 10.0 111.18 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 5.8 t30 -111.93 -59.24 2.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.173 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.43 -30.14 0.56 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.389 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 10.4 m -80.82 47.58 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.941 0.4 . . . . 10.0 111.59 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.56 4.61 53.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.602 0.715 . . . . 10.0 110.018 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -80.83 -26.03 37.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.05 -0.977 . . . . 10.0 109.656 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . 0.653 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 29.4 pt -96.15 167.28 12.69 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.787 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 97.9 Cg_endo -80.34 179.88 5.78 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.276 1.984 . . . . 10.0 112.574 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.6 tp10 -69.65 168.64 14.42 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.651 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.433 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 31.4 t80 -48.23 127.57 12.41 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 122.382 0.273 . . . . 10.0 111.624 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -48.46 128.15 17.26 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.657 2.905 . . . . 10.0 113.614 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.481 HG22 ' HA ' ' A' ' 16' ' ' LEU . 13.2 pt -83.08 50.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.383 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.514 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -100.2 -57.59 0.13 Allowed Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.514 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 54.7 Cg_endo -69.9 120.13 6.95 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.605 1.537 . . . . 10.0 111.098 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.425 ' HB2' ' CD ' ' A' ' 18' ' ' LYS . 4.5 pt-20 -71.44 -8.18 52.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mm -79.54 83.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.491 0.662 . . . . 10.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 -41.98 0.16 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.867 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.597 HD23 HD11 ' A' ' 22' ' ' ILE . 11.8 tp -68.1 -25.57 65.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.506 -0.77 . . . . 10.0 108.981 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 20.9 mp0 -61.17 -36.14 79.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.64 178.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.623 ' HB3' HD21 ' A' ' 8' ' ' LEU . 38.5 mt -74.56 -33.57 62.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.838 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 5.0 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.171 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 28.0 ttp -60.48 -20.98 61.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.672 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.02 -30.56 71.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.449 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.14 -61.68 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.4 41.74 0.63 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.251 0.548 . . . . 10.0 111.369 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.823 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.194 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.406 -0.278 . . . . 10.0 112.406 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' C' ' 25' ' ' LYS . 0.0 OUTLIER -63.07 -61.26 2.5 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.068 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.772 HD21 ' HB3' ' C' ' 85' ' ' LEU . 27.0 tp -62.89 -28.76 70.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.231 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -55.99 -29.7 60.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.489 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -104.89 -34.63 7.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.979 0.418 . . . . 10.0 110.661 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.618 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.8 mt -63.99 -40.82 97.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 10.0 112.0 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' C' ' 86' ' ' LEU . . . -67.49 -29.22 68.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.773 0.321 . . . . 10.0 111.058 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 tp -66.04 -34.88 79.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.332 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.74 -13.44 56.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.543 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.34 -42.11 13.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.239 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.946 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -158.95 116.77 2.84 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.24 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.485 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.5 mt -85.58 88.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.547 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 82.5 tttt -97.62 103.7 17.64 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.737 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.485 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 33.5 Cg_endo -91.57 72.73 0.8 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.248 2.632 . . . . 10.0 111.452 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -131.68 169.71 15.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.497 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -85.09 149.04 25.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.697 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mm -102.02 129.53 53.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.202 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 1.012 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.0 OUTLIER -134.04 145.16 54.55 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.228 -1.027 . . . . 10.0 108.228 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.661 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 45.7 Cg_exo -36.14 131.05 0.36 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.693 2.928 . . . . 10.0 112.678 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.887 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.9 Cg_endo -54.89 152.64 28.22 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 123.401 2.734 . . . . 10.0 113.233 -178.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 mt -74.44 117.99 66.4 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.837 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.15 -23.54 52.8 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.726 2.284 . . . . 10.0 112.287 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.26 61.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.63 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.3 t -108.07 -132.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.27 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.2 ptp180 -158.49 56.29 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 10.0 110.525 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.421 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.9 tttm -152.09 149.75 29.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.334 -0.848 . . . . 10.0 108.876 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.887 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -73.07 154.52 40.39 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.715 0.293 . . . . 10.0 111.108 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.6 m -93.29 165.7 12.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.162 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -113.62 127.74 56.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.592 0.234 . . . . 10.0 110.629 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 1.012 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.5 t70 -172.19 -79.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.795 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.84 -54.44 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 . . . . . 0 C--O 1.247 0.961 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.081 179.944 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmm? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 120.572 0.225 . . . . 10.0 111.482 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.15 115.5 1.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.75 122.11 63.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.272 0.558 . . . . 10.0 111.318 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.517 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 47.4 m-85 -108.13 105.25 14.9 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.629 179.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.845 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.4 OUTLIER -113.31 150.4 32.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.031 0.443 . . . . 10.0 111.499 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' MET . . . . . 0.539 ' HB2' ' HB2' ' B' ' 72' ' ' PRO . 38.5 ttm -120.91 101.36 7.64 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.47 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' ILE . . . . . 0.65 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.5 mm -80.94 113.56 20.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -111.63 101.87 10.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.524 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 21.8 ttp85 -89.75 73.63 7.56 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . 0.75 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.7 t-80 65.09 -81.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.529 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -114.76 0.37 13.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.787 0.327 . . . . 10.0 111.603 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.524 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -106.72 100.03 9.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.158 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 50.2 m -93.89 127.51 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.866 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.616 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 55.5 mt -123.35 117.34 51.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.305 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -82.69 119.01 23.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' THR . . . . . 0.845 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -113.65 113.01 24.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.203 0.525 . . . . 10.0 112.16 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' ASP . . . . . 0.979 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 6.4 t70 -99.26 99.79 10.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.581 -1.266 . . . . 10.0 107.581 178.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.8 -166.18 1.56 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.517 -0.311 . . . . 10.0 111.288 -178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -128.03 158.21 38.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.842 -0.429 . . . . 10.0 109.842 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 5.5 mp0 -56.78 -31.03 64.24 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.365 0.505 . . . . 10.0 112.365 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -17.38 64.68 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 49.5 m -79.43 142.59 35.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.71 0.29 . . . . 10.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.2 p -90.47 167.11 12.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.798 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.417 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -65.12 -32.59 58.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.014 178.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.01 -38.07 89.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.064 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.95 -31.18 72.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.935 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.882 HD11 HD21 ' B' ' 57' ' ' LEU . 85.5 mt -64.85 -42.22 95.07 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.58 -36.12 79.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.648 -0.706 . . . . 10.0 110.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.03 -37.61 87.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.2 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -69.28 -47.8 71.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.538 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.23 -39.4 80.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.638 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -58.79 -38.29 78.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.377 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.25 -11.83 84.65 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.809 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 72.3 mt -103.22 -51.51 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.865 0.364 . . . . 10.0 111.474 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 41.2 mt -84.25 -16.0 44.79 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.494 0.553 . . . . 10.0 112.494 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 mttt 62.05 45.45 7.23 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.531 0.681 . . . . 10.0 110.609 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' B' ' 37' ' ' ARG . 53.4 mtt-85 -133.3 143.66 49.13 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.529 -0.76 . . . . 10.0 109.972 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.79 131.6 46.59 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.12 2.547 . . . . 10.0 112.755 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.05 -16.68 36.4 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.872 2.381 . . . . 10.0 112.036 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.64 -28.21 69.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.434 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -104.93 13.34 31.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.82 0.343 . . . . 10.0 111.812 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -92.48 127.68 38.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.865 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 43.1 mmt-85 -117.37 111.76 19.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.416 -0.357 . . . . 10.0 110.616 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.1 mt -95.97 113.64 25.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.556 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -109.45 115.96 30.92 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.236 0.541 . . . . 10.0 112.435 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -115.43 127.27 55.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.404 -0.816 . . . . 10.0 108.919 178.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 61.91 35.87 16.11 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.51 0.506 . . . . 10.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.15 9.11 7.21 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.394 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -119.7 160.33 22.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.142 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 tp -85.66 139.0 31.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.644 0.259 . . . . 10.0 110.882 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -79.51 170.72 16.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.882 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -112.88 120.47 41.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.945 0.402 . . . . 10.0 110.754 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 0.9 OUTLIER -64.04 -25.99 68.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.297 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.88 13.33 66.29 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.813 -0.708 . . . . 10.0 113.179 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.77 155.17 43.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.034 0.445 . . . . 10.0 111.349 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 24.8 p -87.25 168.58 13.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.166 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.882 HD21 HD11 ' B' ' 27' ' ' LEU . 51.3 mt -60.79 -39.66 89.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.838 0.351 . . . . 10.0 110.654 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.8 -27.71 67.09 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.851 -0.613 . . . . 10.0 112.623 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.0 -26.56 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.061 0.457 . . . . 10.0 110.782 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.0 m -82.46 2.78 31.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.846 -0.615 . . . . 10.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.22 15.95 59.88 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.906 -0.664 . . . . 10.0 113.018 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 41.3 m-85 -86.61 87.39 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.818 0.342 . . . . 10.0 110.789 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.2 p -108.8 170.26 8.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 33.9 m -70.62 -3.78 19.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.079 0.466 . . . . 10.0 111.113 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -88.36 -43.17 11.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -79.05 -30.45 44.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.073 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' ALA . . . . . 0.517 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -118.41 106.57 12.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.03 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.5 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 64.0 mtt180 -113.01 160.08 32.26 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.806 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 12.1 Cg_endo -55.85 -24.47 47.43 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.987 2.458 . . . . 10.0 113.025 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.487 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -115.55 12.97 16.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.707 0.289 . . . . 10.0 111.351 179.396 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -152.83 82.71 4.94 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.741 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.539 ' HB2' ' HB2' ' B' ' 6' ' ' MET . 4.3 Cg_exo -76.03 133.02 14.65 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.884 2.389 . . . . 10.0 111.726 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 114.7 5.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.41 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.56 125.1 26.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.11 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' VAL . . . . . 0.65 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.1 t -124.06 131.01 73.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.27 133.26 11.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.617 -0.801 . . . . 10.0 111.625 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.2 tp -114.7 108.51 16.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.0 0.429 . . . . 10.0 111.453 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.582 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -102.2 141.01 35.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.001 -0.741 . . . . 10.0 109.001 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -119.56 121.63 39.79 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -76.19 96.85 3.99 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.274 0.559 . . . . 10.0 111.456 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -115.43 120.89 41.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.224 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -57.93 132.5 53.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.962 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.28 4.34 4.5 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.369 -0.832 . . . . 10.0 112.693 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 108.79 20.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.11 0.481 . . . . 10.0 110.031 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -82.73 -7.98 59.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.804 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.473 ' O ' HG13 ' B' ' 90' ' ' ILE . 39.0 tt0 -58.45 -29.36 66.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.321 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.8 -38.96 79.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.446 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.04 -27.9 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.539 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 35.0 m -77.14 -26.94 53.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.955 0.407 . . . . 10.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.75 HG12 ' HB2' ' B' ' 10' ' ' HIS . 19.0 mt -88.2 -21.16 7.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.45 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 46.0 tt0 -76.23 112.56 21.61 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.92 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' B' ' 95' ' ' SER . 13.2 Cg_exo -71.63 -7.85 22.01 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.043 2.495 . . . . 10.0 111.959 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.57 -19.13 46.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.163 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -121.39 -35.81 3.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.082 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 95' ' ' SER . . . . . 0.613 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.9 m -119.58 143.71 35.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.106 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 96' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 41.6 Cg_endo -70.19 142.84 47.05 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.326 2.018 . . . . 10.0 111.143 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' PRO . 78.5 Cg_exo -49.82 128.4 21.48 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.182 2.588 . . . . 10.0 112.625 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -65.9 111.67 3.41 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.442 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 12.5 tp -137.42 134.91 18.82 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.509 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 23.9 Cg_exo -65.87 131.09 26.27 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.867 2.378 . . . . 10.0 112.17 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -69.67 -29.69 67.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.092 0.472 . . . . 10.0 110.577 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.439 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.6 m -71.52 -13.01 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.192 0.52 . . . . 10.0 110.76 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' MET . . . . . 0.478 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 83.9 mmm -116.56 17.58 15.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.781 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.604 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 79.9 tttt -85.25 -54.28 0.44 Allowed Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 112.796 0.665 . . . . 10.0 112.796 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.8 Cg_exo -74.15 73.18 3.87 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.208 1.939 . . . . 10.0 111.747 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' GLN . . . . . 0.478 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 29.4 mt-30 -139.61 162.39 35.21 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.25 167.75 15.36 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.874 0.368 . . . . 10.0 111.804 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 131.91 34.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.258 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.38 -154.99 23.92 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.902 -0.665 . . . . 10.0 112.552 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.32 -32.63 17.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.978 0.418 . . . . 10.0 111.149 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.538 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 36.2 m -89.11 163.73 15.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.371 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.71 129.13 38.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 68.85 15.18 8.95 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.645 0.591 . . . . 10.0 111.62 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.538 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.8 tt0 -81.58 121.64 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -103.12 132.91 49.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.828 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.72 109.0 19.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.6 t -78.61 128.36 38.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 10.0 111.68 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.766 0.317 . . . . 10.0 111.446 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -123.08 113.63 19.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.382 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 3' ' ' LEU . . . . . 0.692 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 28.2 mt -83.84 133.3 34.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.167 -0.47 . . . . 10.0 109.845 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.2 mt -117.92 108.82 25.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.2 p -83.61 166.47 18.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.061 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -14.49 60.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 10.0 111.755 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -86.29 -2.64 58.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 10.0 110.604 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.8 23.8 59.24 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.006 -0.616 . . . . 10.0 111.922 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.85 127.58 44.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -94.26 136.49 34.49 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.796 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 11' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -123.92 102.5 7.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.873 0.368 . . . . 10.0 111.207 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 12' ' ' ILE . . . . . 0.616 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 15.8 mm -87.15 115.04 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.4 t -102.82 139.24 24.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.291 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 14' ' ' LYS . . . . . 0.979 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 49.0 tttt -62.38 133.57 55.24 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 45.0 ttt180 -55.34 -35.86 65.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.869 -179.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 16' ' ' GLU . . . . . 0.468 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 62.2 tt0 -54.04 -44.21 70.82 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.102 0.477 . . . . 10.0 110.953 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -81.16 -43.08 19.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.622 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.11 74.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.361 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 19' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.5 mt -64.81 -41.06 96.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.86 0.362 . . . . 10.0 110.765 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 20' ' ' THR . . . . . 0.407 HG21 HG13 ' C' ' 63' ' ' VAL . 3.8 m -65.64 -48.23 72.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 12.3 m -61.01 -33.73 73.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.859 0.362 . . . . 10.0 110.873 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.09 -9.4 71.62 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.052 -0.594 . . . . 10.0 112.345 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 6.0 m -99.44 2.16 44.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.515 0.674 . . . . 10.0 110.052 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.66 160.48 5.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 25' ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 7' ' ' SER . 76.2 tttt -64.95 101.27 0.48 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 10.0 111.144 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 26' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -120.76 166.92 13.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.161 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 27' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 53.6 mmm -76.86 34.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mp -71.61 -25.19 62.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.119 0.485 . . . . 10.0 110.361 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -94.0 16.71 13.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.384 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . 0.452 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -83.74 -56.88 2.53 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.42 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 31' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 26.9 Cg_endo -62.03 166.98 11.39 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.602 2.202 . . . . 10.0 112.706 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.53 92.81 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.887 -0.597 . . . . 10.0 113.069 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -152.93 114.79 4.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.81 0.338 . . . . 10.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -82.31 79.74 8.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.842 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.28 163.06 28.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.273 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 36' ' ' GLU . . . . . 0.404 ' HA ' ' OG1' ' C' ' 39' ' ' THR . 33.2 mt-10 -59.67 -19.5 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -64.22 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 38' ' ' GLU . . . . . 0.504 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.0 OUTLIER -69.31 -20.33 63.88 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.547 179.611 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 39' ' ' THR . . . . . 0.404 ' OG1' ' HA ' ' C' ' 36' ' ' GLU . 2.7 m -74.53 -30.77 61.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.02 0.438 . . . . 10.0 110.647 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -94.06 -55.78 3.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.22 92.95 4.27 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 42' ' ' VAL . . . . . 0.576 ' HB ' HD23 ' C' ' 3' ' ' LEU . 1.6 t -85.82 97.01 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.172 -178.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -84.09 111.65 19.51 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.927 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 44' ' ' PHE . . . . . 0.443 ' HB3' HD12 ' C' ' 47' ' ' ILE . 3.0 m-85 -115.72 109.94 18.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -96.74 163.45 12.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.191 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 69.53 7.17 6.09 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.525 0.516 . . . . 10.0 111.72 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 47' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' C' ' 44' ' ' PHE . 60.1 mt -122.76 106.22 34.71 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.121 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 48' ' ' PRO . . . . . 0.5 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 45.9 Cg_exo -58.6 145.02 96.76 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.874 2.383 . . . . 10.0 112.024 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.7 p -58.35 -41.29 84.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.503 -179.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.95 -55.64 28.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.917 -0.583 . . . . 10.0 112.361 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.6 m -67.62 -34.41 67.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 121.077 -0.249 . . . . 10.0 111.61 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.08 -33.51 75.93 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 39.2 m -61.89 -39.75 93.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.403 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -65.68 -37.67 87.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.314 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 55.2 t -63.99 -44.88 97.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.575 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.3 m -61.18 -39.65 90.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.649 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.9 mtm -68.29 -38.04 81.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 58' ' ' TYR . . . . . 0.618 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 76.4 t80 -63.35 -44.11 95.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.76 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 59' ' ' PHE . . . . . 0.41 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.4 m-85 -63.44 -42.92 98.67 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 179.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 78.9 m -59.05 -43.75 91.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.839 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 61' ' ' TYR . . . . . 0.487 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 53.7 t80 -66.29 -43.6 85.88 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.496 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -60.87 -41.17 95.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.666 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 63' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 59' ' ' PHE . 50.5 t -57.58 -47.14 85.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 10.0 110.392 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -75.11 -40.44 59.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.707 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 65' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -58.83 -43.39 90.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.66 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.79 18.79 4.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.148 0.499 . . . . 10.0 111.111 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -123.75 -68.82 0.85 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.028 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.48 -23.29 4.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.969 0.414 . . . . 10.0 111.842 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.795 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 12.3 m -84.46 27.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.207 0.527 . . . . 10.0 111.808 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -0.32 40.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.26 0.552 . . . . 10.0 110.606 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.86 -17.21 33.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.803 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 33.4 pt -103.44 163.3 17.71 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.836 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -69.16 168.91 19.41 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.928 2.419 . . . . 10.0 112.403 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -70.05 166.87 18.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.082 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 75' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 53.1 t80 -52.12 130.01 40.56 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.859 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 76' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 38.6 Cg_exo -58.49 124.14 15.17 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.809 2.339 . . . . 10.0 112.115 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 77' ' ' ILE . . . . . 0.946 HG22 ' HA ' ' A' ' 16' ' ' LEU . 11.1 pt -78.19 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.341 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 78' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.85 -55.84 0.16 Allowed Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 79' ' ' PRO . . . . . 0.619 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 17.4 Cg_exo -68.41 103.71 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.25 1.967 . . . . 10.0 111.483 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 80' ' ' GLU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 3.7 pt-20 -74.58 58.68 0.79 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.511 0.559 . . . . 10.0 112.511 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 14.8 mm -122.2 -4.73 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.187 0.517 . . . . 10.0 110.796 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 82' ' ' ALA . . . . . 0.582 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -69.38 -34.62 74.82 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.155 -0.34 . . . . 10.0 111.582 -179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 83' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 19.3 tp -68.21 -33.2 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 84' ' ' GLU . . . . . 0.562 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 16.8 mp0 -63.01 -36.51 83.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.219 -0.9 . . . . 10.0 109.663 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 85' ' ' LEU . . . . . 0.772 ' HB3' HD21 ' A' ' 8' ' ' LEU . 76.6 mt -74.39 -34.14 63.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.425 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 86' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -68.26 -17.3 64.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.83 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.0 ttp -63.67 -18.27 63.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.793 179.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.51 75.99 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.477 -0.564 . . . . 10.0 109.477 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.71 -68.49 0.14 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.373 -0.831 . . . . 10.0 112.962 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -80.85 47.52 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.345 0.593 . . . . 10.0 111.266 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 91' ' ' PHE . . . . . 0.541 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 10.6 t80 . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 N-CA-C 111.92 -0.472 . . . . 10.0 111.92 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -62.49 1.78 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.541 0.571 . . . . 10.0 112.541 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.778 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -63.24 -31.03 72.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.606 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.484 ' HA ' ' CD1' ' C' ' 86' ' ' LEU . 2.3 tt0 -54.65 -36.45 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.066 0.46 . . . . 10.0 110.972 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -93.45 -39.97 10.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.453 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 90.0 mt -63.42 -29.56 70.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.684 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.27 -40.95 98.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.795 0.331 . . . . 10.0 110.984 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.4 tp -68.04 -31.87 71.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.206 0.527 . . . . 10.0 109.83 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.12 15.71 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.448 -0.796 . . . . 10.0 110.3 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.78 -39.27 2.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.952 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.626 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.3 OUTLIER -164.94 122.6 1.61 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.906 179.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.3 mt -89.15 87.51 2.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.65 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 59.3 tttt -100.85 111.33 63.01 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.286 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.96 45.11 0.09 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.332 2.688 . . . . 10.0 111.595 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.526 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 14.4 mttm -95.27 175.77 6.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.131 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.36 152.43 27.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.1 0.476 . . . . 10.0 111.52 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.8 mm -113.51 141.82 28.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.879 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.952 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.4 OUTLIER -160.65 144.59 10.26 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.594 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 50.6 Cg_exo -38.5 136.04 0.67 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.331 2.687 . . . . 10.0 112.88 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 25.8 Cg_endo -61.11 134.53 53.23 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 123.119 2.546 . . . . 10.0 112.82 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.24 123.32 87.92 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.254 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.26 -12.72 36.15 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 123.087 2.525 . . . . 10.0 113.074 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -39.54 94.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.122 0.487 . . . . 10.0 110.124 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.545 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.2 t -126.82 -118.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' HG2' HG12 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -163.91 63.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.525 . . . . 10.0 110.476 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.456 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.5 tttm -157.36 153.28 27.06 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.241 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.3 pp -74.14 148.23 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.736 0.303 . . . . 10.0 110.534 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.638 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.8 m -81.45 163.87 22.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.254 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -111.72 102.22 10.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.748 0.308 . . . . 10.0 110.513 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.952 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -150.67 -82.34 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.301 -0.408 . . . . 10.0 110.613 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.36 -54.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.129 -0.323 . . . . 10.0 110.129 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.65 -0.691 . . . . 10.0 109.74 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tmm? . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 121.013 0.435 . . . . 10.0 110.774 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.56 146.67 30.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.813 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.427 HG11 HD13 ' B' ' 57' ' ' LEU . 84.7 t -131.59 118.78 40.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 121.121 0.486 . . . . 10.0 111.362 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.405 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.3 m-85 -108.68 113.86 27.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.902 -0.59 . . . . 10.0 109.94 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.726 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.0 OUTLIER -129.16 159.43 36.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.829 0.347 . . . . 10.0 111.581 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.664 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.9 mtm -127.01 109.02 11.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.845 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.407 ' CG2' ' HB2' ' B' ' 77' ' ' LEU . 48.5 mm -81.69 103.23 8.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.547 -0.909 . . . . 10.0 108.547 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 56.5 ttt180 -101.34 110.94 23.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.382 0.882 . . . . 10.0 113.382 -178.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.423 ' HB2' HD23 ' B' ' 77' ' ' LEU . 5.1 ttp85 -96.18 59.49 1.92 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.42 -1.326 . . . . 10.0 107.42 177.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 66.3 -83.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.948 -1.023 . . . . 10.0 112.112 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -93.22 -7.59 44.73 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.282 0.475 . . . . 10.0 112.282 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.47 HG23 ' HB2' ' C' ' 10' ' ' GLU . 2.0 m -120.84 108.41 13.9 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.738 0.273 . . . . 10.0 111.738 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 28.2 m -103.06 120.65 41.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.733 0.301 . . . . 10.0 110.384 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.624 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.5 mt -108.01 118.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.735 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -77.19 118.56 19.82 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.726 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.8 OUTLIER -111.61 124.32 52.06 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.119 0.485 . . . . 10.0 111.221 -179.152 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.514 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.0 t70 -110.71 97.63 7.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.292 -1.003 . . . . 10.0 108.292 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.36 -167.82 1.62 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.829 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmtm -126.33 164.21 21.54 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.47 -22.96 62.3 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -85.61 -5.23 59.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 13.5 m -82.24 142.71 31.91 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 110.349 -0.241 . . . . 10.0 110.349 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.1 p -90.99 165.38 13.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.779 0.323 . . . . 10.0 110.921 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.532 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 76.7 t -65.62 -34.45 70.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.215 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' B' ' 29' ' ' ARG . 62.1 t80 -61.4 -36.09 79.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -62.69 -38.38 90.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.722 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.652 HD11 HD21 ' B' ' 57' ' ' LEU . 40.4 mt -61.38 -42.99 99.6 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.013 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.88 -37.46 86.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' B' ' 25' ' ' PHE . 62.6 mtp180 -65.82 -34.92 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.041 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 95.2 mt -66.98 -46.31 85.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.04 -37.13 77.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.746 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.56 -39.98 85.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.671 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.6 -1.54 77.37 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.926 -0.654 . . . . 10.0 113.312 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 82.6 mt -114.41 -53.6 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.887 0.375 . . . . 10.0 111.398 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 60.7 mt -90.38 -6.84 54.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.591 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mptt 60.07 38.81 20.35 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.152 0.501 . . . . 10.0 111.678 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.419 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 26.6 mmt180 -116.42 133.1 23.02 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.463 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 44.6 Cg_exo -57.18 133.83 60.12 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 123.073 2.516 . . . . 10.0 112.255 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.5 -22.81 58.43 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.249 2.633 . . . . 10.0 112.614 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -61.5 -37.15 82.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.35 -1.02 57.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.784 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -85.44 135.68 33.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.921 0.391 . . . . 10.0 111.159 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 65.1 mmt-85 -128.0 116.35 19.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.004 178.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 71.7 mt -98.84 118.44 35.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.034 0.445 . . . . 10.0 111.05 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -115.55 112.44 22.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.491 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.55 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.3 tttm -112.78 132.14 55.38 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.68 30.02 19.61 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.107 0.479 . . . . 10.0 110.412 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 68.37 24.19 7.35 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.234 -0.894 . . . . 10.0 111.587 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -130.92 151.47 51.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.127 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.33 130.05 34.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.751 0.31 . . . . 10.0 111.034 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' B' ' 46' ' ' LYS . 95.0 mt -81.93 156.58 24.68 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -99.22 121.99 41.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.739 0.304 . . . . 10.0 110.527 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.532 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 8.5 m-20 -58.51 -29.31 66.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.646 -0.706 . . . . 10.0 112.399 -178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.57 2.53 84.76 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 121.002 -0.618 . . . . 10.0 112.872 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -106.94 154.27 21.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.986 0.422 . . . . 10.0 111.177 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 22.5 p -88.78 162.56 16.14 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.165 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.652 HD21 HD11 ' B' ' 27' ' ' LEU . 24.9 mt -56.98 -36.83 70.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.597 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -34.5 87.14 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.239 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -83.65 -14.12 52.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.049 0.452 . . . . 10.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . 0.543 ' HB3' HD22 ' B' ' 51' ' ' LEU . 58.8 m -95.34 6.46 48.94 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.108 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.96 33.3 37.24 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.404 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.445 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 24.9 m-85 -94.93 55.09 1.79 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.096 0.474 . . . . 10.0 110.618 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.19 148.42 48.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m -60.68 -16.77 42.63 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.77 -26.91 34.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.957 0.408 . . . . 10.0 110.341 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.87 -38.87 12.06 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -103.21 82.69 2.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.985 -1.007 . . . . 10.0 108.883 179.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.55 158.21 34.1 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.769 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.69 -15.81 30.18 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.319 2.013 . . . . 10.0 110.696 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.492 ' HB3' ' HE1' ' C' ' 75' ' ' PHE . 0.7 OUTLIER -94.29 -16.57 23.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.939 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -161.41 93.7 1.41 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.119 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.664 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.6 Cg_exo -72.99 149.73 47.42 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.928 2.419 . . . . 10.0 112.086 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.58 116.29 10.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.017 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.21 115.78 16.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.147 0.499 . . . . 10.0 111.777 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.09 133.46 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -81.68 130.06 9.45 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.017 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.423 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.7 tp -109.74 108.42 18.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.982 0.42 . . . . 10.0 111.197 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -101.74 123.64 46.05 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.652 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -101.11 118.27 36.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -76.29 121.37 22.86 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.09 0.472 . . . . 10.0 111.658 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.87 149.3 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -79.22 133.69 36.68 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.981 -0.288 . . . . 10.0 110.726 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 t70 75.31 -32.84 0.22 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.894 0.701 . . . . 10.0 112.894 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.8 m -69.53 110.9 5.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.961 0.41 . . . . 10.0 110.562 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -84.96 7.35 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.032 0.444 . . . . 10.0 111.61 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.64 -28.04 68.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.26 92.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.97 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -60.57 -30.62 69.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.541 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 44.2 m -70.08 -26.95 64.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.625 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.432 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 1.5 mt -101.11 2.11 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.832 0.348 . . . . 10.0 111.235 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.49 110.04 44.4 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.202 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' B' ' 95' ' ' SER . 32.0 Cg_exo -62.27 -16.12 49.06 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 123.055 2.503 . . . . 10.0 111.93 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -79.14 1.63 23.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.605 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 16.6 m -142.72 -45.71 0.31 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.501 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.54 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 22.3 m -108.38 133.74 20.47 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.081 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.87 153.63 47.9 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.378 2.052 . . . . 10.0 110.672 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -50.01 120.08 5.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.008 2.472 . . . . 10.0 111.915 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -60.53 121.79 13.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.846 -0.616 . . . . 10.0 111.603 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 27.1 tp -144.91 122.98 6.54 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 10.0 109.903 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.59 133.78 47.48 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.626 2.217 . . . . 10.0 111.153 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . 0.492 ' O ' ' HD3' ' B' ' 105' ' ' PRO . 17.8 t70 -61.21 -35.88 78.39 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.545 ' HB ' HG13 ' A' ' 29' ' ' VAL . 23.0 m -69.54 -18.42 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.112 0.482 . . . . 10.0 111.041 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.603 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.7 mmm -110.2 27.91 9.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.506 0.669 . . . . 10.0 109.35 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.457 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 31.1 ttpt -103.22 -49.73 0.15 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.471 -0.786 . . . . 10.0 113.005 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.492 ' HD3' ' O ' ' B' ' 101' ' ' ASP . 5.3 Cg_exo -76.09 51.09 3.03 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.828 2.352 . . . . 10.0 112.16 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.7 mt-30 -123.47 177.3 5.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.594 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.03 -174.4 2.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.728 0.299 . . . . 10.0 111.512 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -93.76 158.31 15.73 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.9 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.6 -137.96 8.28 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.938 -0.648 . . . . 10.0 112.751 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -17.87 22.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.856 0.36 . . . . 10.0 111.532 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 74.7 m -148.86 -174.43 4.62 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.062 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.64 151.19 42.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.67 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.2 t30 73.14 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.354 0.872 . . . . 10.0 113.354 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.458 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 40.1 tt0 -74.28 133.72 42.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.044 0.449 . . . . 10.0 111.702 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -117.09 159.1 23.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.639 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -119.0 106.29 12.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.946 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 t -73.04 123.97 28.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.128 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.325 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.972 0.415 . . . . 10.0 110.868 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' C' ' 41' ' ' GLU . 42.6 tttm -114.19 106.11 13.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.606 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.519 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 64.1 mt -89.89 141.37 28.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.671 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.416 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 21.0 mt -126.98 121.55 58.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -95.78 169.69 9.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.946 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.3 -25.19 65.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.038 -0.528 . . . . 10.0 112.424 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -82.18 6.18 17.4 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.667 0.27 . . . . 10.0 111.382 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 73.99 23.25 76.69 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 10.0 111.638 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -94.67 124.98 39.02 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.47 ' HB2' HG23 ' B' ' 12' ' ' THR . 21.0 mt-10 -96.53 137.58 35.39 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.266 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.519 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -125.69 113.87 17.91 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.257 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.624 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.1 mm -92.94 116.99 35.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.725 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -103.6 134.64 44.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.686 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.514 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 81.5 tttt -66.1 128.42 36.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.471 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 19.0 ttt-85 -54.57 -27.6 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.821 0.674 . . . . 10.0 112.821 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -57.2 -41.78 80.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.022 0.439 . . . . 10.0 110.702 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 -85.69 -32.7 21.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.206 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -60.71 -40.16 91.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.552 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 99.1 mt -57.46 -44.96 85.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.832 0.349 . . . . 10.0 111.089 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -36.12 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.664 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -66.4 -34.41 77.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.095 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.07 -22.32 75.91 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.31 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -71.47 -28.41 63.92 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.293 0.568 . . . . 10.0 110.216 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 20.9 mt -84.47 141.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -65.38 100.24 0.47 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.931 0.396 . . . . 10.0 110.7 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -101.46 178.01 4.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.491 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.586 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 21.6 mmm -78.22 26.33 0.21 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 58.5 mt -74.41 -29.93 61.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.151 0.5 . . . . 10.0 110.256 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -90.44 -0.14 57.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.026 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.93 -62.21 5.7 Favored Glycine 0 CA--C 1.52 0.378 0 CA-C-N 115.765 -0.652 . . . . 10.0 113.348 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.36 174.45 3.41 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.666 2.244 . . . . 10.0 112.52 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.98 -62.12 6.01 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.989 -0.624 . . . . 10.0 112.391 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -130.5 125.9 35.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.808 0.337 . . . . 10.0 111.212 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -109.75 75.7 0.96 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.47 165.8 9.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.332 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -53.54 -39.39 64.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.582 -0.735 . . . . 10.0 111.907 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.08 -39.43 92.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.886 0.374 . . . . 10.0 110.516 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.16 -26.27 65.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.637 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -79.06 -17.87 54.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.315 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -90.78 -55.69 3.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.11 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' C' ' 2' ' ' LYS . 69.8 mm-40 -110.45 96.4 6.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.704 -0.85 . . . . 10.0 108.704 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 t -95.1 103.1 14.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.075 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . 0.416 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 17.6 t-20 -95.33 122.16 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.085 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.642 ' HB3' HD12 ' C' ' 47' ' ' ILE . 83.7 m-85 -104.21 139.82 38.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.703 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -109.27 138.58 45.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.747 0.308 . . . . 10.0 111.297 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 68.97 8.26 6.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.387 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.642 HD12 ' HB3' ' C' ' 44' ' ' PHE . 85.1 mt -108.54 108.7 61.17 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.277 -0.419 . . . . 10.0 110.501 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.62 149.49 84.02 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.941 2.427 . . . . 10.0 112.046 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 2.6 p -60.28 -38.69 84.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.698 -0.683 . . . . 10.0 111.437 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.12 -55.5 30.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.228 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 21.7 m -66.99 -34.44 69.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.238 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.57 -35.54 81.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.549 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' C' ' 57' ' ' MET . 46.5 m -61.47 -42.55 98.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.551 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -64.52 -36.74 85.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.39 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 96.1 t -64.75 -46.85 90.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.71 -41.63 97.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.994 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' C' ' 53' ' ' SER . 44.1 mtm -65.81 -39.58 91.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.511 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.469 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 73.8 t80 -65.27 -41.36 94.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.036 -0.357 . . . . 10.0 110.036 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.6 -46.99 85.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.901 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 32.8 m -58.16 -46.51 85.57 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.722 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -61.37 -46.81 88.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.63 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -61.62 -38.05 86.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.509 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 24.5 t -58.58 -44.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.093 0.473 . . . . 10.0 110.417 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.3 mmt85 -78.28 -41.38 34.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.153 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.553 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 82.7 t80 -57.29 -49.03 77.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.919 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.04 15.18 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.915 0.388 . . . . 10.0 111.437 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 6.6 t30 -119.09 -75.86 0.58 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.628 0.251 . . . . 10.0 111.078 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.66 17.48 5.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 10.0 111.635 -179.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.553 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 66.2 m -126.25 32.32 5.24 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.021 0.438 . . . . 10.0 111.246 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.88 3.48 33.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.44 0.638 . . . . 10.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.69 -23.49 49.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.874 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.627 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 47.4 pt -94.87 164.59 19.11 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.608 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.627 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 62.5 Cg_endo -73.48 169.63 21.84 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.394 2.063 . . . . 10.0 111.706 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.62 163.73 10.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.788 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.492 ' HE1' ' HB3' ' B' ' 70' ' ' GLN . 26.7 t80 -46.95 131.7 8.82 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.969 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -57.94 113.27 1.45 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.962 2.442 . . . . 10.0 111.656 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.0 pt -78.71 45.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.742 -179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.662 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -84.3 -58.01 0.38 Allowed Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 112.388 0.514 . . . . 10.0 112.388 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.662 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 5.0 Cg_exo -79.98 108.93 2.3 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.202 1.934 . . . . 10.0 111.169 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.65 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -76.93 62.01 2.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.479 -179.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 4.3 mm -119.15 4.28 6.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.27 0.557 . . . . 10.0 110.611 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.556 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -77.38 -28.74 52.94 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.15 -0.344 . . . . 10.0 111.128 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.6 tp -70.38 -29.8 66.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.476 -0.564 . . . . 10.0 109.476 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 9.1 mp0 -61.99 -33.95 75.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.184 -0.916 . . . . 10.0 109.608 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.778 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -75.63 -32.62 60.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.495 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.484 ' CD1' ' HA ' ' A' ' 9' ' ' GLN . 52.0 tp -69.45 -17.57 63.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.71 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . 0.458 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 30.5 ttp -64.72 -21.74 66.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.704 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.93 -31.44 72.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.74 -56.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.312 0.856 . . . . 10.0 113.312 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -86.11 56.23 3.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.112 0.482 . . . . 10.0 111.185 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.586 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.879 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 112.213 -0.355 . . . . 10.0 112.213 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.561 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.7 OUTLIER -82.42 -53.67 5.82 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 122.483 0.313 . . . . 10.0 111.797 -179.029 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' C' ' 85' ' ' LEU . 31.7 tp -59.92 -28.64 67.77 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.959 0.409 . . . . 10.0 110.57 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -55.87 -28.97 59.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.132 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -107.11 -36.36 6.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.468 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.559 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.1 mt -60.07 -40.97 91.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.906 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.28 -34.49 72.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.883 0.373 . . . . 10.0 111.223 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.65 -38.36 90.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.85 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.64 -11.48 59.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.164 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -34.5 14.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.846 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.645 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.6 OUTLIER -159.01 112.31 2.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.098 0.475 . . . . 10.0 111.122 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -81.65 90.91 2.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.302 -0.629 . . . . 10.0 109.302 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.557 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 62.8 tttt -101.03 106.96 47.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.273 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -94.7 35.77 0.17 Allowed 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.337 2.691 . . . . 10.0 111.91 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.5 mttm -89.85 175.43 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.113 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -75.42 159.85 30.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.185 0.517 . . . . 10.0 112.022 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.6 mm -115.79 138.23 46.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.917 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.097 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 46.1 tttp -163.96 138.73 4.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -38.91 144.77 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.783 2.989 . . . . 10.0 113.678 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.702 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 37.0 Cg_endo -64.66 154.01 74.53 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.985 2.457 . . . . 10.0 112.785 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.88 126.29 56.1 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.276 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.23 -19.31 63.22 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.272 2.648 . . . . 10.0 112.703 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -35.99 82.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.754 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 t -130.18 -128.75 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.553 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -156.1 59.76 0.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 10.0 110.441 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.435 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 13.5 tttm -155.66 152.35 28.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.737 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.702 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -74.0 160.04 31.86 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.674 0.273 . . . . 10.0 110.927 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.788 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -102.31 162.69 12.72 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.104 -178.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.57 111.45 23.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.699 -0.228 . . . . 10.0 110.874 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.097 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.1 t70 -164.14 -77.57 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.251 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.97 -53.56 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.691 0.62 . . . . 10.0 110.167 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.817 0 CA-C-O 118.301 -0.856 . . . . 10.0 109.691 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.909 0.385 . . . . 10.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -79.39 131.62 36.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.3 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.477 HG11 HD13 ' B' ' 57' ' ' LEU . 90.9 t -118.52 112.99 40.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.184 0.516 . . . . 10.0 110.871 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.692 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 53.7 m-85 -100.2 116.49 32.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.797 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.769 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -129.53 159.62 35.74 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 10.0 111.763 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 15.6 mtm -125.57 105.33 8.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.811 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.52 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.6 mm -81.15 107.16 13.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -107.39 105.02 14.75 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.181 0.808 . . . . 10.0 113.181 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.553 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 12.8 ttp85 -92.35 74.86 5.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.803 -1.555 . . . . 10.0 106.803 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.637 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.9 t-160 67.29 -82.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.399 -0.819 . . . . 10.0 110.433 -177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 81.0 mttt -111.29 -10.54 14.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.796 0.332 . . . . 10.0 111.105 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.6 m -92.06 94.95 9.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.565 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.4 m -98.17 112.92 24.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.06 0.457 . . . . 10.0 110.624 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.508 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.0 mt -107.02 119.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -78.33 119.41 21.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.769 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -112.06 118.34 35.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.3 0.571 . . . . 10.0 111.942 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.898 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -103.27 94.81 5.71 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.942 -1.132 . . . . 10.0 107.942 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -118.44 -168.57 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.842 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.401 ' O ' HD12 ' B' ' 57' ' ' LEU . 2.2 mmtt -127.17 165.47 19.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -63.36 -22.43 66.87 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.814 0.301 . . . . 10.0 111.814 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 2.7 m -83.1 -8.51 59.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.408 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 3.8 m -77.38 136.77 38.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.077 -0.342 . . . . 10.0 110.077 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 21.1 p -86.14 161.45 18.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.716 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -64.31 -36.53 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.999 0.428 . . . . 10.0 110.337 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -63.99 -30.45 71.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.486 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.69 -35.39 80.62 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.272 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.862 HD11 HD21 ' B' ' 57' ' ' LEU . 47.6 mt -60.95 -42.43 98.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.96 -36.83 82.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.309 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 mtp180 -66.13 -39.16 89.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 10.0 109.949 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 82.7 mt -65.73 -48.25 83.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 10.0 109.872 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -63.39 -37.51 79.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.422 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.407 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.4 OUTLIER -59.84 -37.75 80.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.185 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.28 -17.99 79.58 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.938 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.42 -52.15 9.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.983 0.421 . . . . 10.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 34.6 mt -81.44 -17.6 48.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.684 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 63.16 36.47 12.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.802 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -127.87 147.59 63.6 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.76 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.78 130.25 18.77 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.912 3.075 . . . . 10.0 114.134 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 67.4 Cg_endo -76.47 -18.37 15.72 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.846 2.364 . . . . 10.0 111.766 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -65.16 -36.04 82.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.13 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -88.12 0.95 55.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.626 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.22 133.06 34.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.901 0.381 . . . . 10.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.455 ' HB3' ' CE1' ' B' ' 45' ' ' TYR . 83.6 mmt-85 -123.3 110.04 14.7 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 97.2 mt -91.96 116.2 28.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.967 0.413 . . . . 10.0 111.534 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' B' ' 43' ' ' ARG . 74.8 m-85 -115.19 120.98 41.57 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.02 -0.536 . . . . 10.0 112.027 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.466 ' HB3' HD21 ' B' ' 51' ' ' LEU . 21.0 tttm -121.5 127.26 50.85 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.46 36.98 16.94 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 63.8 20.8 12.39 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.656 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -127.34 146.84 50.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.582 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 tp -79.84 131.67 35.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.341 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' B' ' 46' ' ' LYS . 96.6 mt -76.98 156.33 32.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.885 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -95.56 116.51 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.499 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 50.7 m-20 -59.88 -27.91 67.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.569 -0.741 . . . . 10.0 111.928 -179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.07 1.5 88.71 Favored Glycine 0 CA--C 1.519 0.313 0 C-N-CA 120.81 -0.71 . . . . 10.0 113.412 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -113.39 166.3 11.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.583 . . . . 10.0 111.892 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.81 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -95.17 171.25 8.85 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.324 -0.853 . . . . 10.0 109.408 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.862 HD21 HD11 ' B' ' 27' ' ' LEU . 77.2 mt -61.83 -40.99 97.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.52 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.32 -30.58 71.5 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.397 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.75 -12.35 59.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.771 0.32 . . . . 10.0 111.352 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . 0.446 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 58.3 m -100.69 8.78 43.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.76 0.314 . . . . 10.0 111.556 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.53 1.87 68.22 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.831 -0.7 . . . . 10.0 113.107 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.446 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 82.8 m-85 -79.34 106.98 11.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.813 0.339 . . . . 10.0 110.343 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 1.3 p -137.33 174.41 10.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.138 -0.69 . . . . 10.0 109.138 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.11 -3.55 7.76 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.076 0.465 . . . . 10.0 111.537 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -91.18 -42.81 10.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.165 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.49 -34.16 18.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.762 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.692 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -106.24 107.45 18.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.483 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.512 ' HB2' ' HB3' ' B' ' 71' ' ' ALA . 68.9 mtt180 -120.85 158.5 51.98 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.008 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.504 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 9.7 Cg_endo -53.75 -36.49 82.25 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.132 2.554 . . . . 10.0 113.225 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.524 ' HG3' ' CD1' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.84 13.49 24.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 10.0 111.319 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.512 ' HB3' ' HB2' ' B' ' 68' ' ' ARG . . . -150.99 75.53 8.21 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.442 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.96 136.75 16.84 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.679 2.252 . . . . 10.0 111.284 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 117.22 8.97 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.699 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 21.7 m -75.17 126.38 30.91 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.334 0.588 . . . . 10.0 111.63 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.52 ' HB ' HD13 ' B' ' 7' ' ' ILE . 33.2 t -122.02 128.19 75.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.164 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.28 126.33 7.36 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' B' ' 9' ' ' ARG . 44.7 tp -104.92 98.78 8.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.918 0.39 . . . . 10.0 111.121 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.38 116.02 28.57 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -95.97 116.8 29.48 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.691 0.281 . . . . 10.0 110.569 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -74.72 109.22 8.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.448 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -130.18 130.64 44.96 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -65.41 136.05 56.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.422 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 20.2 t70 73.1 -7.38 1.51 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.586 -0.734 . . . . 10.0 112.02 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 17.4 m -95.91 100.38 12.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.094 0.473 . . . . 10.0 109.965 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -72.45 -11.32 60.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.191 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.473 ' HG2' HD11 ' B' ' 90' ' ' ILE . 34.6 tt0 -55.66 -31.67 62.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.358 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.964 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.81 -25.53 59.09 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.842 0.353 . . . . 10.0 111.185 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -87.67 -30.98 19.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.879 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.637 HG12 ' HB2' ' B' ' 10' ' ' HIS . 54.5 mt -78.61 -33.47 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.17 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.48 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 38.0 tt0 -69.46 115.8 36.35 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-O 120.897 0.38 . . . . 10.0 111.677 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.584 ' HA ' ' O ' ' B' ' 95' ' ' SER . 16.3 Cg_exo -69.62 -5.7 16.75 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.471 2.781 . . . . 10.0 112.102 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.48 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 13.8 t80 -68.43 -37.31 80.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.156 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.7 p -108.43 -37.82 5.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.554 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 23.8 m -104.73 141.45 22.57 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.837 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.62 161.78 39.04 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 122.507 2.138 . . . . 10.0 110.719 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.73 135.19 68.28 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.722 2.281 . . . . 10.0 112.398 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -72.79 104.1 3.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 39.4 tp -134.11 121.9 15.9 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.921 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -58.29 127.66 25.63 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.635 2.223 . . . . 10.0 111.665 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.34 -32.83 71.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.362 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.99 -20.23 25.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.16 0.505 . . . . 10.0 111.192 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 75.3 mmm -113.72 33.16 5.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.846 -0.615 . . . . 10.0 109.638 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.576 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.1 ttpt -97.25 -54.86 0.2 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 113.092 0.775 . . . . 10.0 113.092 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 5.8 Cg_exo -74.09 77.29 2.81 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.554 2.169 . . . . 10.0 112.483 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.592 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.5 mt-30 -139.74 172.37 12.88 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.612 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.453 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 44.9 t0 -89.39 167.38 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.0 m -100.59 135.76 41.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.87 0.367 . . . . 10.0 110.311 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.27 -153.71 12.68 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.889 -0.672 . . . . 10.0 112.792 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.4 p -93.49 -28.71 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 10.0 111.039 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.511 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.2 m -86.04 157.04 20.17 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.616 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.17 122.76 17.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.374 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 72.64 16.7 4.7 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 123.721 0.638 . . . . 10.0 111.791 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.5 tt0 -81.88 126.92 32.47 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -105.54 138.9 40.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.462 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -114.41 106.81 14.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.15 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.592 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -74.34 123.5 29.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.155 179.554 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.236 0.354 0 CA-C-O 120.847 0.356 . . . . 10.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.677 ' HE2' HG12 ' C' ' 4' ' ' ILE . 66.8 tttt -108.43 122.29 46.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 10.0 111.004 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 59.3 mt -99.2 124.99 44.68 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.793 HD11 ' HB3' ' C' ' 41' ' ' GLU . 2.9 mt -108.11 126.52 64.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.3 p -99.46 167.42 10.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.55 -0.295 . . . . 10.0 110.459 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.2 m -66.92 -12.75 60.47 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 10.0 111.595 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.22 -5.44 59.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.115 0.483 . . . . 10.0 110.266 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.69 16.2 66.42 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.837 -0.697 . . . . 10.0 111.936 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . 0.404 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -87.39 133.22 33.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 10.0 110.573 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.571 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 12.5 mt-10 -100.52 120.82 40.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.761 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.478 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 91.6 m-85 -112.78 114.32 26.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.614 0.245 . . . . 10.0 110.888 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.508 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 25.9 mm -98.2 119.97 46.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 16.8 t -106.28 136.99 38.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.793 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.898 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 55.5 tttt -60.85 128.92 38.87 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.351 -0.386 . . . . 10.0 109.98 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -52.43 -32.89 41.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.394 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.552 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 40.3 tt0 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.629 . . . . 10.0 111.137 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -81.54 -31.11 32.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.154 0.502 . . . . 10.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.14 92.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.737 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 61.7 mt -59.7 -48.99 79.47 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.759 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.563 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -62.79 -42.6 99.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.985 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -62.85 -39.1 93.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.547 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.68 -13.56 82.02 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.525 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 33.1 m -75.36 -26.88 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.218 0.533 . . . . 10.0 110.283 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 18.0 mt -83.49 153.32 3.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -64.67 93.24 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.936 0.398 . . . . 10.0 110.429 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.561 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -99.58 -178.75 3.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.689 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 67.6 mmm -77.58 28.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.641 0.608 . . . . 10.0 112.641 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.85 -28.41 65.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.094 0.473 . . . . 10.0 110.434 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.7 m -90.39 3.75 52.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.475 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.61 -64.24 3.43 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.695 -0.684 . . . . 10.0 113.461 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.22 175.19 4.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.6 2.2 . . . . 10.0 112.362 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.24 -33.58 64.68 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.293 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -154.47 136.28 14.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.97 0.414 . . . . 10.0 110.861 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -118.45 72.48 0.87 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.43 172.71 8.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.365 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -53.17 -31.19 41.4 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.23 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -62.9 -39.67 95.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.038 0.447 . . . . 10.0 110.378 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.543 ' O ' HG22 ' C' ' 42' ' ' VAL . 0.2 OUTLIER -76.54 -29.12 56.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.608 -0.723 . . . . 10.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -73.3 -27.7 61.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.032 0.444 . . . . 10.0 110.562 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -79.14 -57.81 3.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.755 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.793 ' HB3' HD11 ' C' ' 4' ' ' ILE . 28.3 mt-10 -128.61 109.53 11.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.135 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.543 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.6 t -94.2 109.78 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.179 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 13.3 t-20 -90.33 110.85 21.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.914 0.387 . . . . 10.0 110.949 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.591 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.6 m-85 -90.14 125.45 35.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.014 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -99.14 136.6 38.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.344 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 64.33 25.15 13.42 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.686 0.617 . . . . 10.0 111.278 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' C' ' 44' ' ' PHE . 79.1 mt -124.66 103.91 31.16 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.514 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 31.7 Cg_exo -62.04 154.98 58.45 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.289 2.659 . . . . 10.0 112.346 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 13.2 p -65.02 -35.76 82.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -55.4 -57.06 13.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 10.0 112.226 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.463 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.8 m -66.71 -35.76 75.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.388 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 21.4 tp -64.5 -38.95 92.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.742 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 58.9 m -60.74 -41.54 95.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.38 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . 0.538 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 54.2 tttp -64.49 -38.33 90.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.624 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' C' ' 51' ' ' VAL . 86.8 t -66.03 -44.76 91.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.074 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.3 m -60.73 -44.33 96.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.803 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.5 mtm -66.62 -36.79 83.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.569 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.559 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.1 t80 -64.7 -41.91 95.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.041 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.428 ' O ' HG23 ' C' ' 63' ' ' VAL . 4.2 m-85 -62.19 -44.72 95.96 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.79 -0.448 . . . . 10.0 109.79 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 24.2 m -60.09 -41.41 92.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.749 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' B' ' 70' ' ' GLN . 20.7 t80 -63.45 -44.69 93.77 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.555 -0.748 . . . . 10.0 109.806 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -63.26 -40.14 96.58 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.371 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.563 HG22 ' HB ' ' C' ' 20' ' ' THR . 49.9 t -59.87 -48.28 88.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.275 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.5 mmt85 -72.67 -38.7 67.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.378 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.444 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 85.4 t80 -57.68 -53.72 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.959 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.2 43.21 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.057 -0.519 . . . . 10.0 110.496 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -155.39 -54.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.306 -0.406 . . . . 10.0 111.174 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.91 -40.12 0.95 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.033 0.444 . . . . 10.0 111.506 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.444 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 40.8 m -83.31 53.35 2.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.011 0.434 . . . . 10.0 111.455 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.38 -1.12 45.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.266 0.555 . . . . 10.0 110.342 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' C' ' 69' ' ' SER . 0.0 OUTLIER -89.55 -22.56 22.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.056 179.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.5 pt -90.94 160.98 36.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 72.9 Cg_endo -77.03 176.95 9.49 Favored 'Trans proline' 0 C--O 1.239 0.531 0 C-N-CA 122.156 1.904 . . . . 10.0 112.819 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -67.12 170.22 7.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.975 -1.011 . . . . 10.0 109.74 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -50.24 130.91 24.52 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.475 -0.329 . . . . 10.0 111.084 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.23 125.11 17.78 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.928 2.419 . . . . 10.0 112.621 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.645 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.5 pt -80.57 52.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.799 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -109.51 -56.34 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.475 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.7 Cg_exo -68.13 106.15 1.31 Allowed 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.968 1.779 . . . . 10.0 112.046 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 37.7 mt-10 -73.46 59.35 0.6 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.896 -0.593 . . . . 10.0 112.105 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . 0.659 HD11 ' HA ' ' B' ' 116' ' ' ALA . 10.6 mm -120.48 -7.31 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.573 . . . . 10.0 110.639 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.573 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -67.77 -35.42 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.741 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.557 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 23.9 tp -67.82 -36.15 79.87 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.503 ' HA ' HD23 ' A' ' 32' ' ' LEU . 17.1 mp0 -63.5 -35.75 81.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.116 -0.947 . . . . 10.0 109.64 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.7 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.7 mt -73.56 -35.62 65.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.209 178.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.33 -23.56 67.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.725 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.6 ttp -60.47 -22.04 63.04 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.107 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.52 -34.56 77.13 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.449 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.17 -65.31 0.19 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 124.096 0.873 . . . . 10.0 113.131 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -82.46 55.67 3.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.413 0.625 . . . . 10.0 110.622 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.689 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 1.3 t80 . . . . . 0 C--O 1.246 0.919 0 CA-C-N 115.163 -0.926 . . . . 10.0 108.75 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.496 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.428 -0.269 . . . . 10.0 112.428 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.481 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -66.86 -63.14 1.13 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.454 0.539 . . . . 10.0 112.454 -179.044 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.2 tp -61.02 -27.94 68.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.329 -178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -52.6 -34.1 49.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.105 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -106.47 -35.0 7.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.885 0.374 . . . . 10.0 110.648 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.569 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 61.6 mt -59.34 -45.9 90.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.921 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.673 0.273 . . . . 10.0 111.03 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.5 tp -64.22 -37.51 87.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.272 0.558 . . . . 10.0 110.082 179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.51 -15.02 53.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.638 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.82 -32.71 31.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.696 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.792 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -159.32 114.98 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 10.0 111.618 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 2.0 pt -81.01 94.18 2.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.363 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 79.2 tttt -108.8 95.26 16.37 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.657 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.505 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 1.8 Cg_endo -84.39 78.99 2.66 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.105 2.537 . . . . 10.0 110.936 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 40.1 mttm -130.05 -170.49 2.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.387 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.673 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 49.1 mm-40 -94.16 164.71 12.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.669 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.3 mm -114.56 159.23 14.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.058 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.023 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER 179.92 142.0 0.34 Allowed Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.794 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 51.0 Cg_exo -40.68 135.47 2.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.243 2.629 . . . . 10.0 112.044 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.761 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 35.9 Cg_endo -63.52 137.15 58.21 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.827 2.351 . . . . 10.0 112.388 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.409 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 94.8 mt -61.01 118.33 34.62 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.069 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 25.4 Cg_endo -61.62 -22.18 73.84 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.053 2.502 . . . . 10.0 112.617 -178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.03 -14.55 59.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.046 -0.524 . . . . 10.0 111.2 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.407 HG13 ' HB ' ' B' ' 102' ' ' VAL . 0.2 OUTLIER -133.1 -138.63 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.282 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -154.66 49.23 0.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 10.0 110.085 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -149.55 147.93 28.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.445 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -74.28 159.38 32.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.718 0.294 . . . . 10.0 111.158 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.535 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -99.72 169.04 9.53 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.429 -179.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.673 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 34.2 tt0 -115.86 120.17 38.36 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.298 -0.26 . . . . 10.0 110.298 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.023 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -162.55 -65.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.127 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.468 ' HA ' ' OE1' ' A' ' 21' ' ' GLN . 0.0 OUTLIER 175.07 -57.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.957 -1.127 . . . . 10.0 107.957 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 114.695 -1.139 . . . . 10.0 109.191 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tmm? . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.692 0.282 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.03 134.52 45.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.373 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.43 120.19 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 121.208 0.528 . . . . 10.0 111.707 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.76 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 69.6 m-85 -109.84 114.71 28.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.199 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.78 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.7 160.95 32.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.843 0.354 . . . . 10.0 111.56 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -129.61 107.2 9.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.011 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.559 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.2 mm -81.91 102.4 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.2 ttt180 -101.18 103.41 14.45 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.057 0.762 . . . . 10.0 113.057 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.408 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.3 ttp85 -88.66 71.26 8.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.421 -1.326 . . . . 10.0 107.421 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.622 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.3 t-80 68.02 -81.38 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.193 -0.912 . . . . 10.0 111.098 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -107.28 -16.32 14.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.903 0.382 . . . . 10.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 0.9 OUTLIER -95.09 97.69 10.11 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.102 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 4.3 m -97.24 115.66 28.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.886 0.374 . . . . 10.0 110.549 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.516 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 54.3 mt -106.92 118.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.105 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -77.93 120.8 23.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.78 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -114.05 121.97 45.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.091 0.472 . . . . 10.0 111.976 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.634 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.5 t70 -107.96 98.25 7.85 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.06 -1.089 . . . . 10.0 108.06 178.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.77 -167.75 1.63 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.324 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -126.22 160.61 29.81 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -60.81 -20.62 61.96 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 12.7 m -86.73 -7.91 57.86 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.6 m -78.11 142.59 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.029 -0.36 . . . . 10.0 110.029 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.6 p -90.19 164.06 14.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.787 0.327 . . . . 10.0 110.794 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.4 t -63.26 -39.31 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.369 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -61.59 -32.27 72.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.22 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.96 -38.81 89.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.633 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.727 HD11 HD21 ' B' ' 57' ' ' LEU . 61.8 mt -60.68 -42.42 97.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.033 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -64.84 -35.41 81.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.967 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -66.79 -32.85 74.41 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 77.7 mt -73.18 -46.3 51.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.455 -0.572 . . . . 10.0 109.455 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.7 t -61.52 -34.72 62.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.521 179.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.07 -37.38 71.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.864 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.22 -5.71 89.87 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.905 -0.664 . . . . 10.0 113.072 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -105.15 -49.09 9.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.985 0.421 . . . . 10.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.32 -8.54 54.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.412 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 79.0 mttt 56.92 46.48 19.5 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.377 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 1.0 OUTLIER -142.64 143.09 24.8 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.576 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 37' ' ' ARG . 77.5 Cg_exo -51.84 133.56 45.69 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.438 2.758 . . . . 10.0 113.488 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.94 -16.08 32.63 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.033 2.489 . . . . 10.0 111.957 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.54 -29.05 70.08 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.434 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -96.09 3.12 53.56 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.946 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.98 132.74 35.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 111.207 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 73.0 mmt-85 -123.86 115.89 22.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.073 178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 83.4 mt -93.41 123.09 36.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.163 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -117.26 119.47 35.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.519 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.486 ' HB3' HD21 ' B' ' 51' ' ' LEU . 40.2 tttm -125.1 134.19 52.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 57.74 34.71 24.78 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.296 0.372 . . . . 10.0 110.623 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 65.97 16.14 10.35 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.682 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -123.89 159.76 28.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.825 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.1 tp -87.89 134.32 33.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' B' ' 46' ' ' LYS . 85.8 mt -80.71 152.2 28.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.14 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -92.96 118.47 31.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.143 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 16.3 m-20 -60.25 -26.96 66.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.66 3.74 85.03 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.738 -0.744 . . . . 10.0 113.118 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -108.23 164.99 11.83 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.152 0.501 . . . . 10.0 111.574 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.7 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.2 p -96.34 169.71 9.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.675 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.727 HD21 HD11 ' B' ' 27' ' ' LEU . 32.1 mt -62.37 -39.08 92.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.543 -0.298 . . . . 10.0 111.146 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.15 -39.28 94.27 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.031 -0.604 . . . . 10.0 112.594 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -75.02 -24.28 58.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.006 0.431 . . . . 10.0 110.958 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 63.9 m -85.86 4.44 37.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.766 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.37 14.64 61.61 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.668 -0.777 . . . . 10.0 113.413 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.515 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 57.8 m-85 -87.4 67.23 9.4 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.968 0.413 . . . . 10.0 110.14 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -95.01 161.89 13.95 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 24.8 m -65.83 -7.63 17.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.207 0.527 . . . . 10.0 111.56 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -74.71 -48.54 25.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.313 0.578 . . . . 10.0 109.578 178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.03 -40.5 18.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.453 -0.794 . . . . 10.0 109.971 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.76 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -95.46 100.41 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.55 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -115.39 159.42 38.37 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.707 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -58.38 -19.26 42.55 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.881 2.388 . . . . 10.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -116.41 8.25 14.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.061 179.363 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.457 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -153.14 84.51 4.41 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.597 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.561 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.7 Cg_exo -78.31 137.47 15.05 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.844 2.362 . . . . 10.0 111.33 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.12 115.97 9.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 10.0 111.3 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.18 123.32 21.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.441 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.559 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.6 t -122.41 135.58 62.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.49 135.14 12.95 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.684 -0.77 . . . . 10.0 111.695 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.3 tp -116.81 99.92 7.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.96 0.41 . . . . 10.0 111.552 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -92.87 125.28 37.4 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -106.46 125.36 50.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.699 0.285 . . . . 10.0 110.96 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -75.31 112.18 11.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.061 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.36 139.82 48.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.34 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -77.98 145.1 36.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.392 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 61.14 15.85 6.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.041 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 3.5 m -127.7 107.99 10.37 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.638 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -87.25 4.99 40.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.613 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.503 ' O ' HG13 ' B' ' 90' ' ' ILE . 32.7 tt0 -59.9 -28.71 67.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.419 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.57 68.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.02 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.3 mt -71.36 -28.0 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.895 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 19.1 m -80.99 -25.82 36.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.245 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.622 HG12 ' HB2' ' B' ' 10' ' ' HIS . 6.4 mt -91.36 -9.83 10.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.024 0.44 . . . . 10.0 110.817 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 40.4 tt0 -91.45 107.52 22.35 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.641 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 18.1 Cg_exo -68.59 -11.85 33.06 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 10.0 111.582 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -71.23 -38.22 71.98 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.211 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -100.74 -45.75 5.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.205 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.0 m -106.53 155.35 38.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.493 -0.321 . . . . 10.0 110.771 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 160.81 30.82 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.507 2.138 . . . . 10.0 111.632 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.83 139.85 70.59 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.413 2.075 . . . . 10.0 111.923 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -70.98 96.33 1.29 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.216 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.0 tp -130.46 122.84 20.07 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.95 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.6 Cg_exo -66.01 141.24 63.38 Favored 'Trans proline' 0 C--O 1.231 0.143 0 C-N-CA 122.902 2.402 . . . . 10.0 111.896 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.79 -35.05 79.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.53 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.407 ' HB ' HG13 ' A' ' 29' ' ' VAL . 12.6 m -68.31 -23.38 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.154 0.502 . . . . 10.0 111.012 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.2 mmm -113.88 59.19 0.67 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.162 -0.681 . . . . 10.0 109.162 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.589 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 34.1 ttpt -138.33 -50.88 0.02 OUTLIER Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.565 -0.743 . . . . 10.0 112.269 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 12.5 Cg_exo -73.65 50.6 2.07 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.877 2.385 . . . . 10.0 112.199 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -124.02 160.01 28.6 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.851 -179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.91 175.5 9.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.894 0.378 . . . . 10.0 111.497 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.9 m -99.82 137.69 37.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.511 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.75 -133.44 2.33 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.875 -0.679 . . . . 10.0 112.432 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.57 -43.3 5.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.037 0.446 . . . . 10.0 111.285 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 15.0 m -81.57 161.23 23.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.271 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 135.59 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.58 0.13 3.55 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 123.668 0.605 . . . . 10.0 111.391 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.45 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 40.1 tt0 -79.39 115.83 19.26 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.936 0.398 . . . . 10.0 110.421 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -96.98 138.47 34.46 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.069 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -114.31 108.29 16.73 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.959 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.3 126.57 39.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.372 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.053 179.507 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.966 0.412 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.719 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 77.7 tttt -106.39 117.8 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.051 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.539 HD22 ' HE2' ' C' ' 44' ' ' PHE . 24.9 mt -98.44 123.96 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 20.6 mt -111.51 118.57 57.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -93.38 166.59 12.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.671 -0.24 . . . . 10.0 110.439 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -9.79 29.75 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -87.91 4.25 45.49 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.863 0.363 . . . . 10.0 110.652 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.91 23.89 73.49 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 10.0 111.563 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -96.98 128.23 43.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 10.0 110.659 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.719 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 13.3 mt-10 -101.08 118.39 36.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.785 -0.643 . . . . 10.0 109.387 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.415 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 90.7 m-85 -109.8 117.27 33.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.767 0.317 . . . . 10.0 111.048 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.516 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -100.22 113.42 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.72 136.54 33.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.47 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.634 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.8 tttt -59.59 128.61 37.86 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.27 -0.641 . . . . 10.0 109.27 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 25.1 ttt180 -56.38 -28.34 58.92 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -57.19 -51.97 67.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 10.0 110.196 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -73.63 -29.61 62.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.097 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -65.15 -33.48 76.11 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.073 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 68.5 mt -61.84 -47.46 84.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.231 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.58 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.1 m -66.01 -36.34 83.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.833 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 23.3 m -68.26 -17.93 64.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.441 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -86.55 -16.17 62.5 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.063 -0.815 . . . . 10.0 111.063 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.9 m -83.55 -28.55 28.53 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.351 0.596 . . . . 10.0 109.639 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.11 141.96 15.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -70.38 88.46 0.65 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.356 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.481 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.06 177.05 5.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.396 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.496 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 89.2 mmm -80.07 36.97 0.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.74 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 tp -68.15 -30.33 69.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.415 0.626 . . . . 10.0 109.368 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.63 15.93 10.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.286 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.91 -64.03 3.36 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.525 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.65 169.5 12.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.565 2.176 . . . . 10.0 111.926 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.96 -52.73 50.48 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.116 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -139.08 116.62 11.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.825 0.345 . . . . 10.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -84.84 93.22 8.45 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.4 -0.593 . . . . 10.0 109.4 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.18 165.91 23.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.986 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -59.98 -25.35 65.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.313 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -65.17 -37.9 88.84 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.5 mp0 -74.27 -30.54 62.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.046 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.69 -22.35 58.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.322 0.582 . . . . 10.0 109.74 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -83.63 -61.88 1.72 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.148 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 42.4 mt-10 -130.8 109.33 10.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.512 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 0.6 OUTLIER -90.7 119.98 38.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.856 -179.078 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -93.61 114.41 26.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.9 0.381 . . . . 10.0 110.689 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.631 ' HB3' HD12 ' C' ' 47' ' ' ILE . 71.7 m-85 -103.95 99.09 8.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.359 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -89.12 147.0 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.053 -0.522 . . . . 10.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 69.75 17.91 7.59 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.698 0.624 . . . . 10.0 111.21 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.631 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.3 mt -124.73 109.52 28.14 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.698 -0.683 . . . . 10.0 109.895 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.91 144.52 99.45 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.048 2.499 . . . . 10.0 112.02 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.4 p -62.12 -36.76 82.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -55.19 -55.35 32.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.811 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.487 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.7 m -66.27 -36.26 76.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.865 -0.334 . . . . 10.0 111.214 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -63.89 -36.45 83.96 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.329 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -62.37 -41.7 98.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.058 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -66.11 -37.64 86.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.171 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.487 HG23 ' O ' ' C' ' 51' ' ' VAL . 98.7 t -63.59 -44.72 98.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 N-CA-C 109.645 -0.502 . . . . 10.0 109.645 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 61.5 m -61.25 -42.7 99.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.433 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.4 mtm -65.15 -37.78 88.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.474 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 86.2 t80 -65.15 -43.76 90.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.403 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.44 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.8 m-85 -61.48 -44.03 97.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.003 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 27.0 m -58.77 -43.31 90.37 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.943 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.417 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 32.8 t80 -65.13 -43.77 90.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.145 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -62.57 -40.4 96.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.293 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.58 HG22 ' HB ' ' C' ' 20' ' ' THR . 44.0 t -58.82 -50.89 77.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.447 . . . . 10.0 109.911 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -69.8 -38.78 76.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.353 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.586 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 44.1 t80 -57.87 -46.35 84.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 10.0 110.822 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.62 18.72 3.78 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.343 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 12.6 t30 -125.62 -49.5 1.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.868 0.366 . . . . 10.0 111.553 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.72 -31.24 0.39 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.982 0.42 . . . . 10.0 111.774 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.586 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 6.7 m -81.44 31.7 0.34 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.403 0.519 . . . . 10.0 112.403 -178.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.45 -12.63 60.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.339 0.59 . . . . 10.0 110.215 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -77.16 -30.32 54.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.37 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.702 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 36.7 pt -84.25 165.0 40.98 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.702 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.0 Cg_endo -70.95 167.58 25.57 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.403 2.069 . . . . 10.0 112.872 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -66.4 165.19 14.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.209 -0.905 . . . . 10.0 109.607 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -46.16 126.41 7.3 Favored Pre-proline 0 C--O 1.233 0.223 0 O-C-N 123.56 0.538 . . . . 10.0 111.32 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -51.21 119.72 5.81 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.097 2.532 . . . . 10.0 112.598 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.792 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.8 pt -79.58 47.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.729 -0.668 . . . . 10.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -96.49 -55.87 0.2 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 11.3 Cg_exo -71.15 107.78 2.19 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.032 1.822 . . . . 10.0 111.88 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.57 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 1.8 mp0 -76.79 59.87 1.64 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.741 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 13.3 mm -120.78 -2.66 8.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.268 0.556 . . . . 10.0 110.462 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.472 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -67.7 -34.02 76.06 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.149 -0.344 . . . . 10.0 111.862 -179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 86' ' ' LEU . 28.4 tp -66.11 -35.56 80.82 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.279 0.561 . . . . 10.0 109.797 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.582 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 19.1 mp0 -63.17 -34.4 77.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.254 -0.885 . . . . 10.0 109.717 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 8' ' ' LEU . 82.0 mt -73.82 -31.87 63.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.925 179.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.509 HD12 HD12 ' C' ' 83' ' ' LEU . 97.1 mt -67.24 -17.05 64.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.055 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.6 ttp -69.46 -13.96 62.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.18 -33.32 74.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.932 -0.396 . . . . 10.0 109.932 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.84 -67.84 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.288 0.847 . . . . 10.0 113.288 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -83.89 42.5 0.86 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 10.0 111.437 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 2.6 t80 . . . . . 0 C--O 1.246 0.873 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.692 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.448 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -57.83 -60.03 4.32 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.205 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.742 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.4 tp -62.91 -29.03 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 10.0 112.012 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.484 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 3.4 mt-30 -58.96 -33.37 70.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 10.0 111.125 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -95.93 -37.79 10.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.454 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 93.1 mt -63.69 -45.9 87.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 10.0 112.425 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.07 -28.25 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 10.0 111.308 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.88 -33.09 75.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 10.0 110.373 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.91 -13.03 40.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.243 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.98 -35.49 23.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.708 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HA ' HG22 ' C' ' 77' ' ' ILE . 9.8 tp -159.62 122.44 3.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.371 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 11.1 mt -89.31 88.11 2.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -99.18 102.86 17.12 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.179 0.437 . . . . 10.0 112.179 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 4.3 Cg_endo -89.48 93.1 0.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.162 2.575 . . . . 10.0 110.261 178.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -157.2 177.49 11.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.462 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 45.3 mm-40 -87.36 152.38 22.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.96 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.868 HD11 HD23 ' C' ' 83' ' ' LEU . 49.2 mm -118.13 107.14 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.27 -179.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.817 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 27.9 tttp -117.68 144.32 34.09 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.721 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 24.4 Cg_exo -32.3 133.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 124.265 3.31 . . . . 10.0 113.742 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.831 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.3 Cg_endo -62.2 138.15 70.4 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 123.105 2.537 . . . . 10.0 112.701 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -72.76 124.79 91.16 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.404 179.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.63 -10.36 28.49 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.218 2.612 . . . . 10.0 112.912 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -36.84 85.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.861 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 30' ' ' ARG . 3.1 t -129.24 -103.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.399 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG2' HG12 ' A' ' 29' ' ' VAL . 2.0 ptp180 -178.33 63.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.899 0.48 . . . . 10.0 111.112 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -156.09 145.03 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.831 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.5 pp -72.05 149.5 44.81 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.12 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 2.3 m -84.67 137.7 33.1 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -97.28 80.85 2.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.108 0.48 . . . . 10.0 110.564 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.0 t70 -125.87 -75.76 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.601 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.85 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.468 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.666 -0.683 . . . . 10.0 109.396 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.433 ' HA ' ' OE1' ' B' ' 20' ' ' GLU . 12.1 mmm . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.666 0.27 . . . . 10.0 111.177 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.82 131.02 3.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.144 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.454 HG11 HD13 ' B' ' 57' ' ' LEU . 47.2 t -134.93 121.8 35.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.962 0.41 . . . . 10.0 111.004 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.92 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 34.4 m-85 -111.26 121.01 44.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 10.0 109.719 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.733 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -135.6 160.19 39.28 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.811 0.339 . . . . 10.0 111.366 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.635 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 37.3 mtm -126.45 108.42 11.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.043 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.432 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.3 mm -80.44 103.6 7.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.249 -0.648 . . . . 10.0 109.249 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -98.97 102.64 14.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.636 0.606 . . . . 10.0 112.636 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.554 ' HB2' HD23 ' B' ' 77' ' ' LEU . 15.8 ttp85 -90.46 69.59 6.88 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.228 -1.397 . . . . 10.0 107.228 177.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.7 t-160 68.57 -77.05 0.05 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.393 -0.821 . . . . 10.0 110.888 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.441 ' HD2' ' CD2' ' C' ' 9' ' ' HIS . 74.1 mmtt -112.06 -20.9 11.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.892 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -90.5 101.0 13.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.773 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 3.0 m -100.48 117.19 34.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.949 0.404 . . . . 10.0 110.812 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.577 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 56.4 mt -107.27 116.75 51.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.02 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -76.82 118.32 19.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.733 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.4 m -110.31 117.92 34.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.122 0.487 . . . . 10.0 111.529 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 1.019 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.4 t70 -108.73 103.73 12.88 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.131 -1.063 . . . . 10.0 108.131 178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -135.05 -159.66 0.98 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.902 -178.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -129.73 167.91 17.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 31.8 mp0 -64.81 -23.55 67.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.909 0.385 . . . . 10.0 110.793 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -16.76 63.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.547 -0.751 . . . . 10.0 111.798 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.41 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 7.7 m -78.46 145.54 34.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.746 0.308 . . . . 10.0 110.725 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.7 p -98.39 163.81 12.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.311 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 53.8 t -60.6 -38.09 77.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.912 0.387 . . . . 10.0 110.491 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -61.18 -31.8 71.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.515 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -72.38 -28.12 62.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.772 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.511 HD11 HD21 ' B' ' 57' ' ' LEU . 86.6 mt -65.9 -41.4 91.54 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -60.46 -36.65 78.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.95 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -63.71 -41.01 98.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.144 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -65.77 -47.04 87.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.022 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.32 -40.6 89.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.209 0.528 . . . . 10.0 110.234 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.58 -38.71 92.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.875 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.86 -15.01 66.34 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.735 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.4 mt -103.69 -50.07 9.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 10.0 111.48 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 65.9 mt -83.51 -20.94 33.01 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.635 0.605 . . . . 10.0 112.635 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt 57.77 53.49 7.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.213 0.53 . . . . 10.0 111.61 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 73.4 mtt-85 -139.9 154.51 70.72 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.636 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.48 121.72 6.75 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.55 2.834 . . . . 10.0 113.766 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.44 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 64.5 Cg_endo -74.28 -18.44 20.68 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.868 2.379 . . . . 10.0 112.645 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -70.49 -25.01 62.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.826 0.346 . . . . 10.0 111.846 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -95.68 3.31 54.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 80.4 mt-30 -84.06 102.53 12.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.783 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.771 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.1 mmt-85 -89.65 97.86 11.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.135 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 87.5 mt -82.11 111.29 18.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.31 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -110.25 115.62 30.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' B' ' 51' ' ' LEU . 45.9 tttm -124.39 137.22 54.48 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.231 -1.026 . . . . 10.0 108.231 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 61.71 26.4 16.06 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.253 0.346 . . . . 10.0 110.329 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 72.66 12.47 5.39 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.159 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -127.05 162.27 26.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.382 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.7 tp -82.35 133.64 35.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.587 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' B' ' 46' ' ' LYS . 74.5 mt -77.94 146.76 35.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.73 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HD2' ' B' ' 55' ' ' LYS . 34.7 t0 -94.49 122.26 36.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 10.0 111.592 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 9.1 m-20 -60.88 -26.79 67.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.218 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.47 11.98 59.98 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.508 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HD2' ' HB3' ' B' ' 52' ' ' ASP . 39.8 mttp -126.12 153.86 43.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.005 0.431 . . . . 10.0 111.19 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.8 p -84.45 170.09 13.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.511 HD21 HD11 ' B' ' 27' ' ' LEU . 38.2 mt -61.08 -39.39 89.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.4 -0.363 . . . . 10.0 111.072 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.9 -44.21 96.21 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.64 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -69.94 -19.14 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.858 0.361 . . . . 10.0 111.332 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 81.0 m -89.28 10.26 22.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.933 0.397 . . . . 10.0 111.475 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.82 51.49 5.87 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.654 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.542 ' HE1' ' HB3' ' B' ' 73' ' ' ALA . 9.1 m-85 -114.99 78.62 1.18 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.925 0.393 . . . . 10.0 110.486 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -92.21 168.09 11.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -11.41 57.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.14 0.495 . . . . 10.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -83.71 -40.63 18.63 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.124 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.1 -27.83 26.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.479 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.92 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -114.25 94.85 4.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 55.5 mtt180 -116.04 155.37 48.08 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.769 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.6 -13.39 35.01 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.162 1.908 . . . . 10.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.44 ' OE1' ' HD3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -104.51 -4.96 22.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.948 -1.024 . . . . 10.0 110.056 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.93 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -164.3 93.07 1.01 Allowed Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.965 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.635 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.1 Cg_exo -78.14 140.43 17.74 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.8 2.333 . . . . 10.0 110.914 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . 0.542 ' HB3' ' HE1' ' B' ' 62' ' ' PHE . . . -66.61 113.52 4.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 -179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.43 122.97 20.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.813 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.432 ' HB ' HD13 ' B' ' 7' ' ' ILE . 53.9 t -120.23 132.61 69.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 108.655 -0.868 . . . . 10.0 108.655 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.86 131.25 10.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.244 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' B' ' 9' ' ' ARG . 46.4 tp -109.26 97.05 6.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.964 0.411 . . . . 10.0 111.04 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.771 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.78 105.55 17.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.136 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -88.89 105.63 17.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.133 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 10.0 ttp180 -77.41 116.93 18.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.318 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -125.06 148.58 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.207 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.85 130.1 42.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.383 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t0 61.9 27.76 16.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.534 0.683 . . . . 10.0 111.382 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 13.6 m -124.16 106.05 10.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.241 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -78.52 -9.63 59.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.859 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 44.6 tt0 -56.28 -38.42 71.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.948 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.62 74.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.916 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 18.9 mt -67.14 -24.57 65.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.471 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 13.9 m -84.17 -21.19 31.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.913 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.5 mt -91.91 -34.45 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.108 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 73.8 tt0 -64.24 115.49 20.04 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.58 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.512 ' HA ' ' O ' ' B' ' 95' ' ' SER . 22.6 Cg_exo -66.87 -11.06 30.61 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 123.037 2.491 . . . . 10.0 112.15 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -72.8 -25.86 61.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.765 -0.458 . . . . 10.0 109.765 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.63 -51.4 2.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.597 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.512 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 41.9 m -96.55 139.51 21.69 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.396 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.76 166.38 29.03 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.673 2.249 . . . . 10.0 111.181 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.45 115.19 2.3 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.729 2.286 . . . . 10.0 112.281 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -70.31 99.76 1.6 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.931 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 tp -131.83 128.28 21.56 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.336 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.555 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 71.5 Cg_exo -52.06 124.91 15.82 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.034 2.49 . . . . 10.0 112.151 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.58 -38.79 85.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.459 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 m -67.14 -19.0 24.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.188 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.555 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 66.8 mmm -115.71 41.01 2.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.467 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 35.4 tttm -111.65 -53.13 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 113.294 0.85 . . . . 10.0 113.294 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 8.1 Cg_exo -73.96 66.5 5.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.587 2.191 . . . . 10.0 112.237 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -134.37 173.98 11.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.711 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.838 ' HB2' HE22 ' B' ' 118' ' ' GLN . 2.2 t70 -87.18 179.84 6.57 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.19 -0.3 . . . . 10.0 110.19 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 9.5 m -108.79 148.33 30.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.262 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . 0.43 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -87.75 -150.16 18.82 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.26 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.6 -31.59 15.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.293 0.568 . . . . 10.0 110.458 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.93 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.3 m -96.09 163.78 12.97 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.092 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.18 140.55 54.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.18 -8.14 1.04 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.623 0.577 . . . . 10.0 111.73 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.43 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 37.9 tt0 -75.56 125.89 29.93 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -110.27 156.15 21.08 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.977 0.417 . . . . 10.0 111.143 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.44 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -123.15 103.3 8.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.045 179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.25 126.79 34.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.577 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.838 HE22 ' HB2' ' B' ' 107' ' ' ASP . 15.2 mp0 . . . . . 0 C--O 1.237 0.43 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.193 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.049 0.452 . . . . 10.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 80.2 tttt -109.71 122.58 47.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.575 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 41.1 mt -99.28 132.26 44.73 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.916 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' C' ' 41' ' ' GLU . 11.2 mt -114.51 119.64 62.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.721 0.296 . . . . 10.0 110.22 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 m -85.55 156.52 20.72 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.319 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.7 m -61.82 -25.13 67.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.355 0.502 . . . . 10.0 112.355 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -9.22 58.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.845 0.355 . . . . 10.0 111.263 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.83 28.87 8.02 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.686 -0.768 . . . . 10.0 112.895 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . 0.441 ' CD2' ' HD2' ' B' ' 11' ' ' LYS . 8.7 m170 -101.61 145.76 28.62 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.785 -0.244 . . . . 10.0 110.346 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.447 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 21.8 mt-10 -114.74 130.76 56.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.358 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 78.7 m-85 -122.91 118.85 28.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.496 -0.32 . . . . 10.0 110.801 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 24.4 mm -102.04 118.58 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 25.3 t -106.84 139.89 26.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 121.229 -0.188 . . . . 10.0 110.77 -179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 1.019 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 70.4 tttt -60.26 128.5 37.07 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 58.1 ttt180 -54.3 -32.85 57.43 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.983 0.364 . . . . 10.0 111.983 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.498 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 42.3 tt0 -58.34 -37.98 76.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.016 0.436 . . . . 10.0 110.937 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -86.08 -40.17 16.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.178 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.35 90.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.987 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 72.7 mt -59.65 -46.2 89.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.934 0.397 . . . . 10.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 2.5 m -67.81 -32.35 72.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.527 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 25.7 m -69.12 -34.78 75.59 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.1 -10.5 84.18 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.555 -0.748 . . . . 10.0 111.657 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 7.9 m -81.13 -21.49 39.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.92 -0.771 . . . . 10.0 108.92 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -81.28 154.69 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.247 -1.02 . . . . 10.0 108.247 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -73.53 82.59 1.49 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.992 0.425 . . . . 10.0 110.732 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -91.52 170.06 10.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.955 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.692 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 82.6 mmm -78.89 45.13 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.527 0.565 . . . . 10.0 112.527 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.87 -26.47 62.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.273 0.559 . . . . 10.0 109.554 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.76 6.05 37.01 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.392 -0.822 . . . . 10.0 110.346 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.03 -58.44 14.52 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.432 -0.804 . . . . 10.0 113.338 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.47 -175.48 1.58 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.264 1.976 . . . . 10.0 111.899 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.62 -58.71 5.68 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.69 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -137.23 118.32 14.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.69 0.281 . . . . 10.0 110.282 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -79.79 83.18 5.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.148 0.499 . . . . 10.0 110.049 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.94 158.57 34.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.197 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.9 -27.67 60.98 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.752 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -60.37 -45.24 94.22 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.715 -0.476 . . . . 10.0 109.715 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.542 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.3 tp10 -74.29 -28.91 61.41 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.523 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -67.48 -26.25 66.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 10.0 110.789 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -89.98 -57.63 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.687 ' HB3' HD11 ' C' ' 4' ' ' ILE . 19.4 mt-10 -119.44 93.22 4.0 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.791 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -80.54 108.53 14.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.125 -178.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . 0.54 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 27.2 t-20 -92.57 118.25 30.81 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.761 0.315 . . . . 10.0 110.246 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.586 ' HB3' HD12 ' C' ' 47' ' ' ILE . 91.7 m-85 -95.33 138.99 32.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 10.0 111.953 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 11.4 mmt85 -105.48 135.37 47.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.123 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 62.04 27.46 16.6 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.722 0.638 . . . . 10.0 111.796 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.586 HD12 ' HB3' ' C' ' 44' ' ' PHE . 81.6 mt -124.56 107.06 29.53 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-O 121.072 0.463 . . . . 10.0 111.02 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.445 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 16.5 Cg_exo -70.84 138.38 34.26 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.204 2.603 . . . . 10.0 111.913 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . 0.437 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 0.9 OUTLIER -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.97 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -34.17 71.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.06 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.524 ' HB ' HD21 ' C' ' 85' ' ' LEU . 17.4 m -93.59 -27.89 4.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.676 -0.41 . . . . 10.0 110.586 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 46.0 tp -67.39 -34.0 76.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.951 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.93 -40.27 92.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.052 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -65.49 -35.38 80.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.403 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.16 -42.98 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.616 -0.513 . . . . 10.0 109.616 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 47.1 m -62.86 -41.48 99.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.352 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 60.9 mtm -66.49 -37.14 84.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.614 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.581 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -64.02 -44.1 93.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.165 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.431 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.2 m-85 -61.88 -44.24 97.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.281 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 30.1 m -60.62 -42.54 97.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.836 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -65.19 -42.04 93.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.997 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 20.9 tptt -62.79 -42.62 99.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.523 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 59' ' ' PHE . 68.3 t -60.03 -46.21 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.605 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.4 mmt85 -72.4 -38.47 68.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.958 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.879 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 74.6 t80 -59.8 -55.34 35.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.134 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 51.94 1.83 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.989 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -170.14 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.309 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.77 -38.27 1.01 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.326 0.491 . . . . 10.0 112.326 -178.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.879 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.3 m -83.75 28.44 0.58 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.919 0.39 . . . . 10.0 111.78 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.48 -12.96 61.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.844 0.354 . . . . 10.0 111.0 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -82.74 -20.42 36.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.73 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.738 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.42 169.08 8.6 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.758 -0.201 . . . . 10.0 110.463 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.738 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 71.9 Cg_endo -77.98 173.32 14.17 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.272 1.982 . . . . 10.0 113.002 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.557 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 15.4 tp10 -70.12 177.69 3.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 10.0 109.692 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.557 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 5.2 t80 -53.94 127.35 53.46 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 109.844 -0.428 . . . . 10.0 109.844 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -54.4 120.26 7.73 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.76 2.307 . . . . 10.0 112.315 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.735 HG22 ' HA ' ' A' ' 16' ' ' LEU . 12.5 pt -76.16 55.93 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.396 0.617 . . . . 10.0 110.917 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.669 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.28 -56.69 0.11 Allowed Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.834 -0.621 . . . . 10.0 112.187 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.669 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 16.9 Cg_exo -68.19 121.01 7.97 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.691 1.594 . . . . 10.0 110.529 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -77.62 29.02 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 46.9 mm -116.71 96.71 4.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.121 -0.696 . . . . 10.0 109.121 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.14 -40.94 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.431 -0.804 . . . . 10.0 109.605 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.868 HD23 HD11 ' A' ' 22' ' ' ILE . 4.4 tp -67.56 -22.77 65.38 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.617 -0.882 . . . . 10.0 108.617 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.701 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 31.9 mp0 -64.83 -32.76 74.6 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.812 -1.085 . . . . 10.0 109.164 177.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.742 ' HB3' HD21 ' A' ' 8' ' ' LEU . 64.9 mt -80.44 -33.55 36.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.297 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.484 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.6 tt -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.104 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . 0.456 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 36.2 ttp -63.61 -16.79 61.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.415 -0.811 . . . . 10.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.28 69.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 10.0 111.093 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.51 -68.65 0.17 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.053 0.76 . . . . 10.0 113.053 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -82.04 45.8 0.95 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.139 0.495 . . . . 10.0 111.342 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.244 0.809 0 N-CA-C 108.941 -0.763 . . . . 10.0 108.941 179.614 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 120.719 0.066 . . . . 10.0 112.962 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -68.67 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.324 0.861 . . . . 10.0 113.324 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.841 HD21 ' HB3' ' C' ' 85' ' ' LEU . 16.1 tp -61.6 -29.14 69.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.553 -0.294 . . . . 10.0 111.351 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.54 -31.41 46.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.116 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -105.07 -42.9 5.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.383 179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.547 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 82.5 mt -57.88 -41.44 82.51 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.26 70.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.729 0.3 . . . . 10.0 111.788 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.7 tp -67.75 -31.01 70.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 10.0 111.379 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.3 11.02 7.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.173 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.51 -52.6 1.6 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.011 0.434 . . . . 10.0 110.572 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' C' ' 77' ' ' ILE . 5.3 mt -131.56 94.36 3.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.341 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.425 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.9 mt -73.76 100.83 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.885 0.374 . . . . 10.0 110.544 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.701 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 83.6 tttt -103.69 101.8 26.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.59 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 83.7 Cg_endo -90.3 58.75 1.57 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.988 2.458 . . . . 10.0 111.91 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.701 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 30.4 mttm -110.02 -170.53 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.54 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.813 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 35.7 mm-40 -87.51 163.45 16.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.1 mm -112.61 144.84 19.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.669 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.034 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -172.33 138.85 0.97 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.006 -0.738 . . . . 10.0 109.006 179.309 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.742 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 71.4 Cg_exo -42.74 140.13 3.0 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.198 2.598 . . . . 10.0 112.423 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.64 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 44.8 Cg_endo -67.14 134.52 34.23 Favored 'Trans proline' 0 N--CA 1.465 -0.147 0 C-N-CA 122.846 2.364 . . . . 10.0 112.229 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.597 ' H ' HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -75.97 119.24 76.32 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.367 179.182 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 18.3 Cg_endo -60.27 -15.28 33.96 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 123.286 2.657 . . . . 10.0 113.305 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -32.41 73.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.251 0.548 . . . . 10.0 109.638 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.843 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -128.42 -127.24 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.434 -0.803 . . . . 10.0 108.861 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -163.45 61.21 0.17 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.446 0.641 . . . . 10.0 110.223 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 12.1 tttm -157.03 150.69 24.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.086 -0.961 . . . . 10.0 108.815 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.64 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.9 pp -73.9 150.56 40.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.782 0.325 . . . . 10.0 110.751 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.5 m -88.06 169.51 11.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.824 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.813 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 17.5 tt0 -116.77 121.97 43.1 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.975 -0.379 . . . . 10.0 109.975 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.034 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.0 t70 -166.9 -75.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.252 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 170.96 -47.48 0.01 OUTLIER 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.322 -179.803 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.1 tmm? . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.866 0.365 . . . . 10.0 110.526 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.67 138.71 50.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.141 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.0 t -131.04 120.17 46.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.152 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.526 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.2 m-85 -109.48 120.71 43.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.472 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.757 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -131.69 159.33 38.7 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.8 0.333 . . . . 10.0 111.341 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.572 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 46.6 mtm -128.74 109.54 11.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.77 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 38.7 mm -82.05 105.19 11.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -104.87 104.58 14.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.07 0.767 . . . . 10.0 113.07 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.409 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 18.3 ttp85 -93.68 81.34 4.27 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.215 -1.402 . . . . 10.0 107.215 177.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.452 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.4 t-160 65.52 -85.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.353 -178.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -112.69 -13.34 13.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.137 0.494 . . . . 10.0 111.222 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.9 m -90.19 103.12 15.83 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -104.13 123.71 47.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.743 0.306 . . . . 10.0 111.138 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.596 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 66.1 mt -113.85 118.42 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.751 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . 0.433 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 68.2 t80 -79.54 121.54 25.36 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 178.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.757 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -114.73 122.28 45.93 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.245 0.545 . . . . 10.0 111.969 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.818 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -104.97 102.91 12.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.016 -1.105 . . . . 10.0 108.016 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.51 -166.33 1.62 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.952 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -134.9 161.25 35.76 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.965 -0.754 . . . . 10.0 108.965 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 6.8 mp0 -58.27 -28.99 65.45 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -10.97 60.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.1 m -85.67 147.1 26.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.388 -0.227 . . . . 10.0 110.388 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.4 p -91.67 164.14 13.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.747 0.308 . . . . 10.0 111.05 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.477 HG11 ' HB3' ' B' ' 51' ' ' LEU . 7.4 t -67.5 -32.67 58.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 10.0 110.179 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -62.09 -35.97 80.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.343 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.58 -35.41 79.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.883 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.64 HD11 HD21 ' B' ' 57' ' ' LEU . 73.7 mt -61.33 -40.82 95.64 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.051 0.453 . . . . 10.0 109.859 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -63.21 -35.36 80.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.082 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -69.46 -33.78 73.42 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.938 -0.574 . . . . 10.0 109.802 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' B' ' 27' ' ' LEU . 96.1 mt -67.62 -44.32 86.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 85.9 t -63.83 -36.1 75.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.32 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 30.5 tt0 -61.76 -37.28 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.815 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.36 -13.36 79.89 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.7 -0.762 . . . . 10.0 112.531 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -104.32 -56.09 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 10.0 111.73 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.3 mt -82.72 -11.52 58.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.706 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 96.0 mttt 58.72 42.93 19.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.85 -0.614 . . . . 10.0 112.455 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' B' ' 37' ' ' ARG . 48.4 mtt-85 -129.71 141.47 41.93 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.172 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -53.67 130.97 41.57 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.145 2.563 . . . . 10.0 113.104 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.06 -13.65 34.18 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.98 2.453 . . . . 10.0 112.473 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.47 -37.33 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.413 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -96.22 9.56 40.65 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.42 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -90.08 126.49 35.8 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.775 0.321 . . . . 10.0 111.091 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 43' ' ' ARG . 81.1 mmt-85 -119.7 113.15 20.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' B' ' 51' ' ' LEU . 94.9 mt -94.09 130.13 40.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.954 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -123.01 122.38 38.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.351 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.459 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.1 tttm -124.66 133.95 53.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.142 -0.688 . . . . 10.0 109.142 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 59.18 37.74 23.82 Favored 'General case' 0 C--O 1.234 0.27 0 O-C-N 123.458 0.474 . . . . 10.0 111.543 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 64.9 18.37 11.45 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.43 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -129.17 155.31 45.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.324 -0.398 . . . . 10.0 111.176 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 63.7 tp -76.09 138.51 40.84 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.924 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.477 ' HB3' HG11 ' B' ' 24' ' ' VAL . 33.9 mt -89.49 158.51 17.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.645 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' B' ' 53' ' ' ASP . 8.8 t70 -80.36 -160.85 0.32 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.465 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.467 ' H ' ' CG ' ' B' ' 52' ' ' ASP . 1.0 OUTLIER -135.05 -57.05 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.013 0.435 . . . . 10.0 110.322 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.79 -23.35 64.51 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.645 -0.707 . . . . 10.0 113.087 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -69.71 154.66 41.66 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.784 0.325 . . . . 10.0 110.581 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 40.9 p -86.97 166.79 14.82 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.238 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.64 HD21 HD11 ' B' ' 27' ' ' LEU . 36.5 mt -60.97 -40.81 94.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.833 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.81 -28.4 65.7 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.92 -0.657 . . . . 10.0 112.587 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -84.43 -11.58 55.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.803 0.335 . . . . 10.0 111.309 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 38.9 m -103.77 11.88 35.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.058 0.456 . . . . 10.0 111.915 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.04 8.11 69.43 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.337 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 63.2 m-85 -87.86 90.48 8.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.579 -0.365 . . . . 10.0 110.625 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.1 p -122.88 167.93 12.92 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.6 m -67.46 -4.43 11.32 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -89.52 -44.62 9.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.98 -33.94 26.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.248 0.547 . . . . 10.0 109.755 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.526 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -107.18 100.58 10.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.295 -0.866 . . . . 10.0 109.196 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -109.9 158.01 36.14 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.959 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.07 -18.5 63.82 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.439 2.093 . . . . 10.0 111.502 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 11.6 pt20 -107.56 4.69 26.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.362 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.568 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -163.62 86.97 1.24 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.782 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.572 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.4 Cg_exo -76.27 146.05 27.89 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.829 2.353 . . . . 10.0 111.332 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 117.01 15.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.109 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.3 m -72.84 126.14 29.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.168 0.509 . . . . 10.0 111.656 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.7 t -123.2 133.19 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.01 134.49 12.67 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.695 -0.764 . . . . 10.0 111.759 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.43 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 48.2 tp -110.88 101.75 10.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.888 0.375 . . . . 10.0 111.167 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.08 101.27 12.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -83.96 113.92 21.33 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.714 -0.476 . . . . 10.0 109.714 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -72.3 94.49 1.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.499 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -111.77 120.42 41.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.955 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.03 144.17 55.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.863 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.08 -5.05 2.02 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.737 0.648 . . . . 10.0 111.985 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m -111.98 104.72 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.012 0.434 . . . . 10.0 110.2 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -76.52 -7.92 56.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.87 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.46 ' O ' HG13 ' B' ' 90' ' ' ILE . 47.9 tt0 -56.97 -32.96 66.6 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.025 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.08 74.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.852 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.74 -29.68 68.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.665 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 21.3 m -78.9 -21.62 47.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.398 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.46 HG13 ' O ' ' B' ' 86' ' ' GLU . 27.1 mt -89.22 -18.61 7.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.25 0.548 . . . . 10.0 109.927 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.665 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 37.3 tt0 -80.68 111.93 27.31 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.203 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.632 ' HA ' ' O ' ' B' ' 95' ' ' SER . 67.9 Cg_endo -75.48 10.82 1.74 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.935 2.424 . . . . 10.0 112.111 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.665 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 45.2 t80 -91.78 -31.88 15.59 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 13.2 m -116.04 -16.36 11.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.323 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.632 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.1 m -128.28 147.26 62.89 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.249 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -73.78 156.77 48.44 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.444 2.096 . . . . 10.0 111.65 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.1 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.548 2.165 . . . . 10.0 111.706 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -59.23 114.98 2.9 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.433 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.522 HD11 HE22 ' B' ' 115' ' ' GLN . 22.3 tp -138.92 129.69 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.613 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.6 Cg_exo -60.65 130.32 32.88 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.768 2.312 . . . . 10.0 111.357 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.08 -35.46 80.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.95 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.843 ' HB ' HG13 ' A' ' 29' ' ' VAL . 22.3 m -67.97 -17.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.602 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 90.7 mmm -114.2 13.29 17.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.887 0.375 . . . . 10.0 110.746 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -82.12 -50.04 0.85 Allowed Pre-proline 0 CA--C 1.541 0.61 0 N-CA-C 113.198 0.814 . . . . 10.0 113.198 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -76.92 61.47 7.12 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.128 1.885 . . . . 10.0 112.447 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 59.2 mt-30 -130.55 150.53 51.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.536 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.709 ' HB2' HE22 ' B' ' 118' ' ' GLN . 0.2 OUTLIER -77.87 158.32 29.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.064 -0.516 . . . . 10.0 111.441 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 37.9 m -73.16 138.6 45.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.374 -0.375 . . . . 10.0 110.407 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.72 -118.07 2.27 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.919 -0.658 . . . . 10.0 112.467 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -114.97 -46.29 2.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.986 0.422 . . . . 10.0 111.059 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 17.5 m -70.87 165.93 22.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.234 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . 0.568 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.79 120.12 13.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.197 -0.456 . . . . 10.0 109.799 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.2 t30 68.81 31.09 4.54 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.735 0.647 . . . . 10.0 111.014 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -87.1 135.64 33.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.098 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.522 HE22 HD11 ' B' ' 99' ' ' LEU . 0.8 OUTLIER -114.85 127.24 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.036 0.446 . . . . 10.0 111.38 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -100.91 115.32 30.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.539 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.489 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 1.8 t -73.29 118.08 18.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.415 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.709 HE22 ' HB2' ' B' ' 107' ' ' ASP . 16.4 mp0 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.778 0.323 . . . . 10.0 110.929 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' C' ' 41' ' ' GLU . 32.9 ttpt -112.44 117.5 32.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.886 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.7 mt -89.21 135.57 33.5 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.433 HD11 ' HB3' ' C' ' 41' ' ' GLU . 35.9 mt -116.5 121.31 67.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 120.845 0.355 . . . . 10.0 110.64 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.85 165.85 13.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.117 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 14.4 m -64.24 -26.6 68.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.688 0.28 . . . . 10.0 111.646 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . 0.535 ' OD2' ' HA ' ' C' ' 48' ' ' PRO . 14.2 m-20 -75.4 -3.21 32.43 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.149 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.95 10.56 66.44 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.122 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . 0.452 ' HB2' ' HB3' ' C' ' 49' ' ' SER . 0.2 OUTLIER -79.29 139.9 37.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.833 0.349 . . . . 10.0 110.561 179.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.417 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.7 mt-10 -111.79 133.78 53.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.945 -0.571 . . . . 10.0 109.679 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.448 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 85.8 m-85 -124.81 111.03 15.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.866 0.365 . . . . 10.0 111.687 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 11.2 mm -93.31 115.77 32.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 15.9 t -102.06 142.09 17.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.502 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.818 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 67.5 tttt -62.21 130.89 47.48 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.756 -0.461 . . . . 10.0 109.756 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 49.0 ttt180 -48.17 -42.26 29.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.591 . . . . 10.0 112.176 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.411 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 48.5 tt0 -56.54 -49.19 75.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.965 0.412 . . . . 10.0 111.385 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -68.91 -36.17 77.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.951 0.405 . . . . 10.0 110.397 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.5 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.365 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 88.8 mt -60.6 -47.96 83.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.03 0.443 . . . . 10.0 110.832 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.566 ' HB ' HG22 ' C' ' 63' ' ' VAL . 2.2 m -62.85 -45.86 90.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.54 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 15.7 m -65.77 -24.37 66.93 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.056 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.78 -6.55 86.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.042 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 41.2 m -88.05 -28.19 21.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.287 0.565 . . . . 10.0 109.855 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -78.11 150.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.241 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.42 96.9 0.26 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.161 0.505 . . . . 10.0 110.652 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -103.67 176.21 5.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.019 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.631 ' SD ' ' HA3' ' C' ' 30' ' ' GLY . 1.1 tmm? -83.79 31.43 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.57 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.91 -29.84 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.386 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.8 p -90.57 -0.52 57.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.341 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . 0.631 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . -70.39 -56.02 8.15 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-N 115.65 -0.705 . . . . 10.0 114.576 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 25.0 Cg_endo -60.72 -13.02 24.01 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.988 2.459 . . . . 10.0 114.002 -179.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 124.85 -112.05 1.67 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.766 -0.73 . . . . 10.0 111.961 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -100.22 109.88 22.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.94 0.4 . . . . 10.0 110.038 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -86.55 103.84 15.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.818 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.37 167.29 9.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.408 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -52.77 -27.16 16.68 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 10.0 112.539 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -57.93 -33.75 69.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.04 0.448 . . . . 10.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -97.77 -24.92 15.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.264 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -64.69 -33.78 76.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.56 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -70.32 -52.54 22.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.176 0.512 . . . . 10.0 109.93 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' C' ' 2' ' ' LYS . 52.3 mt-10 -133.9 100.57 4.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.406 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 t -80.38 108.22 13.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.19 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -89.44 124.05 34.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.15 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.595 ' HB3' HD12 ' C' ' 47' ' ' ILE . 82.6 m-85 -104.77 128.62 52.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.688 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' C' ' 45' ' ' ARG . 8.1 mmt180 -101.48 140.69 35.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.485 -0.325 . . . . 10.0 111.006 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 60.11 31.45 20.57 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.304 0.573 . . . . 10.0 111.545 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.595 HD12 ' HB3' ' C' ' 44' ' ' PHE . 92.2 mt -131.21 110.79 15.36 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.499 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.535 ' HA ' ' OD2' ' C' ' 7' ' ' ASP . 17.8 Cg_exo -68.88 149.49 72.47 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 123.08 2.52 . . . . 10.0 111.925 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' C' ' 9' ' ' HIS . 1.8 p -65.6 -31.71 72.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.749 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -56.27 -54.4 45.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.631 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.58 -33.61 57.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.767 0.318 . . . . 10.0 111.112 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.8 tp -64.81 -32.97 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.884 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 56.2 m -59.98 -40.63 89.81 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.806 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -68.01 -35.1 77.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.382 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 44.6 t -66.41 -43.8 90.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.046 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.418 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 69.9 mtm -67.04 -36.45 82.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.229 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.547 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 83.6 t80 -63.83 -42.61 97.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 7.1 m-85 -60.79 -46.21 91.37 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.622 178.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -58.13 -43.31 87.19 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.451 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 26.5 t80 -66.41 -45.53 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.473 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.8 tptt -62.5 -40.89 98.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.419 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.566 HG22 ' HB ' ' C' ' 20' ' ' THR . 41.5 t -58.45 -44.75 89.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.161 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 64' ' ' ARG . 12.2 mmt85 -74.37 -43.74 55.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.597 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.523 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 47.1 t80 -54.45 -43.47 71.65 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.905 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.93 14.71 13.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.082 0.468 . . . . 10.0 111.808 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -123.44 -62.28 1.33 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.94 0.348 . . . . 10.0 111.94 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 4.7 m -148.83 38.58 0.83 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.092 0.472 . . . . 10.0 110.711 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.523 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 19.7 m -147.75 36.0 0.86 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.17 0.51 . . . . 10.0 110.57 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.07 0.93 55.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.435 0.636 . . . . 10.0 110.108 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -75.91 -29.58 58.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.609 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 pt -94.9 159.53 33.0 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.681 -0.691 . . . . 10.0 109.247 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.81 -175.6 2.18 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.452 2.101 . . . . 10.0 112.509 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' C' ' 75' ' ' PHE . 12.0 tp10 -68.76 175.91 3.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.454 -0.793 . . . . 10.0 110.248 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.445 ' H ' ' HG3' ' C' ' 74' ' ' GLU . 32.5 t80 -52.4 130.59 43.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.508 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.31 116.34 2.77 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.099 2.532 . . . . 10.0 111.813 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.78 ' HA ' HD23 ' A' ' 16' ' ' LEU . 10.2 mt -78.06 72.2 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.395 0.617 . . . . 10.0 111.272 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -120.4 -59.65 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.287 -0.869 . . . . 10.0 111.419 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.569 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 72.3 Cg_endo -77.71 102.78 1.63 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.597 1.531 . . . . 10.0 111.28 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.51 69.89 2.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.968 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -119.15 10.62 6.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.426 0.631 . . . . 10.0 110.08 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.702 ' HB2' ' HB2' ' A' ' 16' ' ' LEU . . . -73.35 -35.51 65.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.15 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.545 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 19.7 tp -66.0 -34.96 79.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.416 ' HA ' HD23 ' A' ' 32' ' ' LEU . 19.5 mp0 -64.13 -33.7 76.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.592 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.841 ' HB3' HD21 ' A' ' 8' ' ' LEU . 90.1 mt -77.2 -34.15 56.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.715 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.2 -12.13 61.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.768 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 47.7 ttp -62.71 -17.42 60.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 10.0 111.465 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.7 -9.75 58.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.781 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.91 -80.62 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 O-C-N 123.826 0.704 . . . . 10.0 112.421 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -101.8 83.7 2.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.522 0.677 . . . . 10.0 111.84 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.317 -0.843 0 N-CA-C 107.626 -1.25 . . . . 10.0 107.626 178.558 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.455 ' HA2' ' OE1' ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.751 0 N-CA-C 112.779 -0.128 . . . . 10.0 112.779 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -67.78 -59.66 3.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.769 0.285 . . . . 10.0 111.414 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.666 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 15.5 tp -63.85 -24.05 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.053 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.455 ' OE1' ' HA2' ' A' ' 6' ' ' GLY . 60.4 mt-30 -54.81 -46.31 74.51 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.007 0.432 . . . . 10.0 110.399 178.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -88.97 -33.66 17.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.504 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 63.7 mt -59.66 -42.54 93.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.774 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.76 -40.52 79.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.899 0.38 . . . . 10.0 110.626 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.4 tp -66.72 -32.29 73.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.268 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.75 -3.43 56.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.607 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.3 -34.01 9.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.068 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.656 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.8 OUTLIER -161.75 118.19 2.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.015 179.667 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 4.4 mp -81.8 94.13 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 178.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 22.1 tttt -102.04 104.72 38.03 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 18.5 Cg_endo -93.81 68.95 0.41 Allowed 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.336 2.691 . . . . 10.0 110.214 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -120.93 -175.66 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.129 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -90.62 155.43 18.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.512 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.7 mm -118.3 126.95 75.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.058 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.1 OUTLIER -145.66 141.45 16.86 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 108.508 -0.923 . . . . 10.0 108.508 179.339 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.436 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 29.5 Cg_exo -34.07 129.04 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.879 3.053 . . . . 10.0 113.143 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.744 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.3 Cg_endo -57.01 134.62 65.74 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.21 2.607 . . . . 10.0 112.566 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.482 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -73.64 125.96 90.11 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.034 179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -68.91 -12.22 33.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.95 2.433 . . . . 10.0 112.179 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -36.84 84.83 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.849 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB ' ' B' ' 102' ' ' VAL . 2.7 t -126.58 -114.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.13 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.432 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.4 ptp180 -168.44 53.64 0.05 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.085 0.469 . . . . 10.0 110.958 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.7 tttm -151.17 152.01 32.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.622 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.744 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.4 pp -73.96 150.94 40.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.719 0.295 . . . . 10.0 110.708 179.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.602 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.2 m -92.9 169.58 10.34 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.343 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.402 ' H ' HG22 ' A' ' 33' ' ' THR . 19.0 mt-10 -120.12 123.4 43.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 10.0 110.408 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.981 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.5 OUTLIER -163.84 -70.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.666 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 174.0 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.545 -0.909 . . . . 10.0 108.545 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.125 -0.943 . . . . 10.0 109.09 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.777 0.322 . . . . 10.0 111.259 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -107.98 133.91 51.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 10.0 111.776 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 86.8 t -122.48 116.47 49.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.422 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 47.1 m-85 -102.82 118.27 36.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.545 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.715 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -129.31 158.47 39.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.919 0.39 . . . . 10.0 111.501 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 2.0 mtm -127.49 108.08 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.5 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.568 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -81.07 113.43 20.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.201 -0.666 . . . . 10.0 109.201 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -109.97 107.03 16.79 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.721 0.637 . . . . 10.0 112.721 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.573 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 25.7 ttp85 -96.97 74.29 2.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.306 -1.368 . . . . 10.0 107.306 177.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.64 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.7 t-160 68.31 -82.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.267 -177.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -115.61 -9.37 12.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.963 0.411 . . . . 10.0 110.928 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 7.2 m -93.15 98.66 11.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.82 128.73 44.65 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.694 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.602 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 69.3 mt -123.42 118.54 54.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.48 -0.327 . . . . 10.0 110.79 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -79.05 124.03 27.89 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.715 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -117.72 125.19 50.2 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.144 0.497 . . . . 10.0 111.707 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.419 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 8.2 t70 -108.73 99.68 9.01 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.01 -164.26 1.1 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.495 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm -130.22 165.36 22.56 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.422 ' O ' ' HB ' ' B' ' 56' ' ' THR . 25.0 mp0 -62.54 -29.53 70.63 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 57.7 m -78.43 -7.62 57.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 15.3 m -76.85 130.27 37.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 36.6 p -82.9 162.34 21.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.72 0.295 . . . . 10.0 110.769 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.824 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 78.1 t -63.94 -32.39 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.91 0.386 . . . . 10.0 110.451 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.38 -32.84 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.209 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.56 -33.51 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.435 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.731 HD11 HD21 ' B' ' 57' ' ' LEU . 91.9 mt -61.63 -46.0 91.68 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -61.82 -35.5 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.453 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 33.3 mtp180 -63.24 -38.21 90.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 10.0 109.998 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -69.1 -45.21 80.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.791 -0.641 . . . . 10.0 110.065 179.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.86 -38.57 82.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.419 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.834 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 3.8 tm-20 -58.93 -37.89 77.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.538 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.51 1.13 83.46 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.966 -0.561 . . . . 10.0 113.028 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 98.9 mt -113.52 -55.13 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.859 0.361 . . . . 10.0 110.772 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.09 -12.32 57.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.543 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt 58.48 49.98 9.92 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.91 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' B' ' 37' ' ' ARG . 57.1 mtt-85 -138.94 143.67 38.17 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.166 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.31 124.26 11.54 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.355 2.703 . . . . 10.0 113.069 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.834 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.2 Cg_endo -72.52 -16.52 27.21 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.804 2.336 . . . . 10.0 111.156 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.42 -29.11 69.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.011 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -98.29 5.49 48.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.893 0.378 . . . . 10.0 111.437 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -88.37 133.21 34.15 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.519 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.413 ' HD3' HH11 ' B' ' 43' ' ' ARG . 49.3 mmt-85 -119.65 114.88 22.87 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.53 120.88 37.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.618 -0.265 . . . . 10.0 110.382 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 83.6 m-85 -117.29 130.41 56.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.509 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 43.5 tttm -135.06 133.97 39.88 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 62.83 29.73 16.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.397 0.436 . . . . 10.0 110.57 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 72.23 6.17 5.47 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.309 -0.859 . . . . 10.0 111.852 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -120.77 161.77 20.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.1 tp -77.85 145.04 36.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.844 0.354 . . . . 10.0 111.319 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 34.9 mt -87.69 151.43 22.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.932 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -97.07 108.51 21.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.124 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.824 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.5 m-20 -51.06 -44.34 61.14 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 113.337 0.865 . . . . 10.0 113.337 -178.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -70.58 -7.16 60.56 Favored Glycine 0 CA--C 1.518 0.245 0 CA-C-N 116.13 -0.486 . . . . 10.0 114.226 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -102.6 162.18 13.13 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 117.107 0.453 . . . . 10.0 111.106 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.739 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 38.2 p -90.73 167.23 12.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.081 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.731 HD21 HD11 ' B' ' 27' ' ' LEU . 33.7 mt -59.93 -40.95 90.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.621 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.54 -37.23 88.21 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.055 -0.593 . . . . 10.0 112.201 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.96 -9.85 59.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.647 0.26 . . . . 10.0 111.512 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.6 m -102.71 8.66 39.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.987 0.422 . . . . 10.0 111.036 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.95 65.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.29 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.509 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 31.2 m-85 -87.08 76.79 9.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.94 0.4 . . . . 10.0 110.334 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.23 155.56 17.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.165 -0.471 . . . . 10.0 109.762 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 5.1 m -66.08 -11.97 52.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 10.0 111.376 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -75.76 -28.36 58.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.018 0.437 . . . . 10.0 110.465 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.25 -48.49 4.37 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -89.08 82.02 6.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.204 -0.907 . . . . 10.0 109.307 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.425 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 53.8 mtt180 -94.4 158.88 34.97 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.963 -178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 21.5 Cg_endo -62.95 -16.08 51.8 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.537 2.158 . . . . 10.0 111.925 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -105.69 2.92 28.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.411 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.83 82.98 2.01 Favored Pre-proline 0 C--O 1.233 0.235 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.878 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.41 132.57 25.93 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.712 2.275 . . . . 10.0 111.473 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.54 119.53 8.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.784 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.93 124.45 26.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.928 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.568 ' HB ' HD13 ' B' ' 7' ' ' ILE . 25.5 t -123.0 130.89 74.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.53 131.19 10.31 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.709 -0.758 . . . . 10.0 111.924 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.4 tp -113.9 110.75 20.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.987 0.422 . . . . 10.0 111.363 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -106.79 124.38 49.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.683 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -105.41 114.08 28.04 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.295 -0.261 . . . . 10.0 110.295 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 -71.64 113.53 8.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.031 0.443 . . . . 10.0 111.243 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.563 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -127.73 130.1 48.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.563 179.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -59.95 134.9 57.48 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.409 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.7 t70 71.27 -10.44 0.79 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.336 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.563 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 5.0 m -100.03 100.39 11.26 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.167 0.508 . . . . 10.0 110.276 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -77.21 1.13 19.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.7 -0.682 . . . . 10.0 112.28 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.29 -33.01 68.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.943 0.401 . . . . 10.0 110.27 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.14 82.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.022 -0.535 . . . . 10.0 111.238 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 91.0 mt -75.32 -7.09 53.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.567 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 18.6 m -96.85 -27.88 14.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.061 0.458 . . . . 10.0 110.344 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' B' ' 10' ' ' HIS . 34.2 mt -88.07 -31.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.481 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.417 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 39.1 tt0 -64.27 114.65 14.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.573 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.606 ' HA ' ' O ' ' B' ' 95' ' ' SER . 31.3 Cg_exo -63.3 -22.37 72.1 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.091 2.527 . . . . 10.0 111.827 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -67.95 -26.75 66.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.267 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -106.57 -40.0 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.881 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.606 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 74.1 m -128.82 136.16 28.72 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.539 0.209 . . . . 10.0 110.941 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.43 155.38 62.7 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.709 2.273 . . . . 10.0 111.812 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.19 133.32 41.43 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.107 2.538 . . . . 10.0 112.591 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.57 104.45 3.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.856 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 33.4 tp -131.19 124.21 20.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.221 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.8 Cg_exo -61.55 138.08 73.39 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.812 2.341 . . . . 10.0 111.923 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.11 -38.74 87.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.003 0.43 . . . . 10.0 111.309 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.587 ' HB ' HG13 ' A' ' 29' ' ' VAL . 8.8 m -65.25 -18.23 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.241 0.543 . . . . 10.0 111.049 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.544 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 92.7 mmm -113.81 44.34 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.105 -0.702 . . . . 10.0 109.105 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.699 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 70.1 tttt -120.29 -51.26 0.04 OUTLIER Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.631 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.699 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 71.6 Cg_endo -75.42 55.26 4.11 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 122.223 1.949 . . . . 10.0 112.48 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.544 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 68.0 mt-30 -127.25 148.78 50.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.244 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -74.77 160.11 31.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 17.8 m -90.31 136.49 33.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.478 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.98 -135.05 2.34 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 121.187 -0.53 . . . . 10.0 113.262 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.62 -53.08 4.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.861 0.363 . . . . 10.0 111.376 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.884 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 23.7 m -70.64 159.81 33.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.398 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.42 127.12 30.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.072 -0.513 . . . . 10.0 109.989 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 t30 71.95 17.79 5.15 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.806 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.801 ' HG3' ' HB2' ' B' ' 111' ' ' SER . 0.5 OUTLIER -76.41 120.12 21.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -100.32 124.28 45.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.072 0.463 . . . . 10.0 111.258 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -106.59 97.1 6.94 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.47 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -60.86 128.29 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.303 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.974 179.88 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.234 0.244 0 CA-C-O 120.902 0.382 . . . . 10.0 110.828 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.797 ' HB3' ' HG2' ' C' ' 41' ' ' GLU . 5.3 ttpp -105.29 107.57 18.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.742 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 43.7 mt -91.33 113.64 25.96 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 5.5 mt -102.89 122.91 55.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.601 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.0 p -94.38 167.66 11.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -9.37 29.18 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.099 0.407 . . . . 10.0 112.099 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -86.61 -4.83 59.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.134 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.99 17.57 69.55 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.253 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.45 126.17 39.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 33.3 mt-10 -94.95 134.31 37.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.717 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 99.2 m-85 -123.4 104.89 9.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.77 0.319 . . . . 10.0 111.106 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.627 HD11 ' HD3' ' C' ' 2' ' ' LYS . 24.4 mm -88.69 115.75 29.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.403 -0.591 . . . . 10.0 109.403 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 41.8 t -105.86 127.78 60.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.622 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.419 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 77.9 tttt -54.99 129.4 37.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.29 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.476 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 32.4 ttt-85 -57.45 -30.86 65.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 10.0 112.038 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.16 -43.15 73.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.052 0.453 . . . . 10.0 110.644 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -81.33 -41.74 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.614 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . 0.476 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -56.26 -33.78 65.79 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.733 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 50.9 mt -59.35 -44.93 92.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.85 0.357 . . . . 10.0 110.379 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.571 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.2 m -65.25 -46.42 80.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.417 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -37.43 86.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.924 0.392 . . . . 10.0 110.524 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.47 -17.77 74.82 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 116.064 -0.516 . . . . 10.0 112.09 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -80.65 -25.93 37.99 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 41.3 mt -79.41 154.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.413 -0.812 . . . . 10.0 108.931 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -71.8 87.64 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.006 0.432 . . . . 10.0 111.319 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.49 179.69 5.45 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.316 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.29 36.02 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.986 0.422 . . . . 10.0 111.48 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 9.9 tp -66.98 -31.71 72.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.326 0.584 . . . . 10.0 109.845 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 9.72 24.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.348 -0.842 . . . . 10.0 110.589 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.61 -64.47 3.69 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.877 -0.602 . . . . 10.0 112.475 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.61 177.11 7.22 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.694 2.262 . . . . 10.0 111.477 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.19 -77.6 0.27 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.969 -0.634 . . . . 10.0 112.215 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -117.21 116.88 28.14 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 10.0 110.521 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -95.3 89.87 5.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.82 164.43 26.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.198 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.8 -26.52 58.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.109 -0.496 . . . . 10.0 112.023 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -59.11 -52.76 64.34 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.529 -0.545 . . . . 10.0 109.529 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.463 ' O ' HG22 ' C' ' 42' ' ' VAL . 4.7 mp0 -72.63 -20.28 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.319 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 7.1 m -71.76 -29.6 64.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 10.0 110.69 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -93.03 -33.46 14.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.732 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.797 ' HG2' ' HB3' ' C' ' 2' ' ' LYS . 30.8 mt-10 -135.5 98.81 4.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.04 0.447 . . . . 10.0 110.301 179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.463 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.1 t -90.38 132.4 35.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.314 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -106.44 115.15 29.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.478 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.514 ' HB3' HD12 ' C' ' 47' ' ' ILE . 89.2 m-85 -104.1 112.88 26.06 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.511 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -102.86 148.19 25.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.15 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 70.13 14.59 7.69 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.687 0.617 . . . . 10.0 110.725 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.514 HD12 ' HB3' ' C' ' 44' ' ' PHE . 69.5 mt -125.19 108.27 27.41 Favored Pre-proline 0 N--CA 1.455 -0.203 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.38 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 32.0 Cg_exo -61.24 150.75 83.19 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.122 2.548 . . . . 10.0 112.384 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.2 p -61.46 -39.81 92.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . 0.413 ' CE1' ' HG3' ' B' ' 103' ' ' MET . 59.6 m80 -52.86 -56.52 15.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 10.0 112.66 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.478 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.4 m -65.2 -35.9 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.929 -0.308 . . . . 10.0 111.255 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -66.0 -35.21 79.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.418 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -61.19 -43.32 99.07 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.37 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -65.92 -35.85 81.77 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.218 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.478 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -64.12 -46.51 93.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.539 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.8 -42.52 99.11 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.624 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.53 -37.8 83.28 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.664 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.8 t80 -63.73 -44.03 94.76 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.995 -0.372 . . . . 10.0 109.995 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.6 m-85 -62.9 -44.21 96.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.087 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 58.6 m -57.83 -45.02 86.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.321 0.581 . . . . 10.0 109.783 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -65.56 -44.84 85.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.072 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -60.49 -40.64 92.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.296 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.571 HG22 ' HB ' ' C' ' 20' ' ' THR . 38.2 t -58.0 -48.48 84.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.458 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -74.01 -39.01 63.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.242 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.488 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 63.0 t80 -58.01 -45.57 86.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.416 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.41 23.95 2.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.131 0.491 . . . . 10.0 110.667 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -128.86 -62.41 1.01 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.57 -25.52 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.488 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.4 m -83.61 34.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.275 0.472 . . . . 10.0 112.275 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -6.5 59.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.567 0.698 . . . . 10.0 109.658 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -65.87 -26.48 67.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.172 -0.922 . . . . 10.0 110.738 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.632 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 23.0 pt -102.77 164.72 15.02 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.639 . . . . 10.0 109.437 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 74.0 Cg_endo -74.8 -170.85 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.458 2.105 . . . . 10.0 112.717 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -72.09 165.88 23.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.655 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -48.66 128.15 13.77 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 123.463 0.477 . . . . 10.0 111.011 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -50.14 121.89 8.34 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 123.104 2.536 . . . . 10.0 112.586 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.656 HG22 ' HA ' ' A' ' 16' ' ' LEU . 19.7 pt -79.04 52.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.669 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.518 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -99.34 -56.47 0.16 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.182 -0.463 . . . . 10.0 112.214 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.518 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 57.6 Cg_endo -70.21 117.4 5.09 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.616 1.544 . . . . 10.0 111.022 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 5.6 pt-20 -73.67 -2.61 23.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.689 0.625 . . . . 10.0 112.689 -178.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 39.7 mm -81.62 72.73 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.594 0.711 . . . . 10.0 110.604 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -137.89 -38.23 0.58 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.218 -0.901 . . . . 10.0 109.424 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.404 HD22 ' HG2' ' A' ' 18' ' ' LYS . 12.0 tp -67.97 -24.73 65.19 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.945 -0.761 . . . . 10.0 108.945 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.507 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 23.8 mp0 -62.98 -31.76 72.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.699 178.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.663 ' HB3' HD21 ' A' ' 8' ' ' LEU . 54.6 mt -77.66 -32.4 53.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.548 -0.751 . . . . 10.0 109.649 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -22.09 63.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.386 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.1 ttp -66.6 -19.71 65.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.872 -0.604 . . . . 10.0 111.332 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.68 -34.28 77.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.986 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.39 -56.97 0.5 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.959 0.787 . . . . 10.0 112.54 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -82.49 41.31 0.7 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.144 0.497 . . . . 10.0 110.592 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.241 0.647 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.525 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 112.475 -0.25 . . . . 10.0 112.475 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -68.97 -65.22 0.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.672 0.619 . . . . 10.0 112.672 -179.12 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.649 HD21 ' HB3' ' C' ' 85' ' ' LEU . 17.2 tp -61.31 -30.96 70.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.022 -178.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -54.73 -29.7 54.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.944 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -105.09 -37.32 6.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.587 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.596 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 80.6 mt -64.06 -44.6 91.96 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.12 -30.32 66.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.859 0.362 . . . . 10.0 111.298 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 38.8 tp -66.27 -35.69 81.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.163 0.506 . . . . 10.0 110.254 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.28 -2.43 52.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.002 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -100.99 -23.2 14.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.822 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.546 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 12.3 tp -169.46 109.77 0.44 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.099 -0.5 . . . . 10.0 111.075 179.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.8 mt -82.92 83.69 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.566 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 21.5 tttt -92.35 111.37 50.15 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.394 -179.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -91.97 38.82 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.12 2.547 . . . . 10.0 112.554 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 45.5 mttm -93.48 166.13 12.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.772 0.32 . . . . 10.0 110.844 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -82.93 156.54 23.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -106.67 143.7 17.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.287 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.021 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -157.31 140.77 11.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 108.086 -1.079 . . . . 10.0 108.086 178.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.537 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 27.7 Cg_exo -36.08 131.52 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.802 3.001 . . . . 10.0 113.052 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.642 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.7 Cg_endo -57.18 144.05 91.56 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.432 2.755 . . . . 10.0 113.25 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mt -75.41 122.02 86.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.896 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.81 -23.28 75.89 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 123.037 2.492 . . . . 10.0 112.897 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -31.18 72.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.151 0.5 . . . . 10.0 110.47 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.484 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 m -128.46 -139.33 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.227 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.484 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 1.1 ptp180 -149.89 60.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.329 0.585 . . . . 10.0 110.352 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.428 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.4 tttm -154.64 150.55 27.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.894 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -72.98 152.65 41.27 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.837 0.351 . . . . 10.0 111.453 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.68 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.9 m -90.32 168.37 11.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.837 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 33' ' ' THR . 11.0 tt0 -114.49 107.75 15.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.782 0.325 . . . . 10.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.021 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 5.6 t70 -157.94 -82.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.337 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 178.6 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 O-C-N 123.482 0.489 . . . . 10.0 110.614 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.294 -0.86 . . . . 10.0 110.689 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.3 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.935 0.398 . . . . 10.0 110.512 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -77.7 135.55 38.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.406 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 94.4 t -120.67 118.84 57.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.991 0.424 . . . . 10.0 110.563 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.613 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 59.2 m-85 -106.19 112.01 24.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.057 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -127.37 158.8 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.82 0.343 . . . . 10.0 111.179 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.579 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.9 mtm -127.0 107.28 9.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.636 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.445 ' HB ' ' HB ' ' B' ' 14' ' ' ILE . 48.6 mm -78.43 106.33 8.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.115 -0.698 . . . . 10.0 109.115 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -101.75 101.52 12.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.259 0.552 . . . . 10.0 112.487 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.742 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.6 ttp85 -91.72 72.56 5.81 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.377 -1.342 . . . . 10.0 107.377 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.658 ' HB2' HG12 ' B' ' 90' ' ' ILE . 11.7 t-160 67.6 -80.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.075 -177.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' C' ' 9' ' ' HIS . 58.1 mttt -116.02 -5.46 11.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.97 0.414 . . . . 10.0 111.132 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.742 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 3.0 m -96.58 94.6 7.44 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 2.9 m -95.86 112.31 24.07 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.939 0.4 . . . . 10.0 110.851 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 44.8 mt -106.37 116.8 50.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.988 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -77.15 116.83 18.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.72 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -112.1 112.29 23.8 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.335 0.588 . . . . 10.0 111.854 -178.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.895 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.3 t70 -100.76 103.48 14.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.432 -1.321 . . . . 10.0 107.432 178.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.13 -164.39 1.28 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.314 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -125.4 153.55 43.24 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.884 -0.413 . . . . 10.0 109.884 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.23 -27.35 61.95 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.169 0.433 . . . . 10.0 112.169 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -8.6 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 16.4 m -84.4 147.61 27.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.622 0.249 . . . . 10.0 110.704 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 8.2 p -92.42 163.47 13.84 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.313 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 83.5 t -64.0 -36.71 77.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.591 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.17 -32.51 71.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.588 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' B' ' 29' ' ' ARG . 39.1 mt-10 -67.3 -31.59 71.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.066 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.494 HD11 HD21 ' B' ' 57' ' ' LEU . 85.1 mt -62.26 -42.38 99.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.705 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 94.9 mttt -62.95 -37.35 86.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.061 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' B' ' 26' ' ' GLU . 81.6 mtp180 -61.84 -43.22 99.29 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.968 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.09 -48.93 81.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.093 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.6 t -61.14 -36.45 72.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.758 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.494 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.1 tt0 -60.66 -35.02 75.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.148 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.72 -18.52 72.81 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.574 -0.822 . . . . 10.0 112.276 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 78.3 mt -92.21 -53.46 8.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.749 0.309 . . . . 10.0 111.226 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.4 mt -84.08 -13.28 53.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 mttt 63.01 32.58 15.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.675 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -121.0 138.83 28.3 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.24 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.5 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 77.3 Cg_exo -50.33 135.08 39.07 Favored 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.314 2.676 . . . . 10.0 112.895 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.705 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 7.1 Cg_exo -74.02 -16.1 23.04 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.037 2.491 . . . . 10.0 112.521 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.78 -35.99 79.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.027 -0.533 . . . . 10.0 112.028 -178.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -101.49 16.99 23.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -92.29 124.42 36.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 78.1 mmt-85 -112.24 114.05 26.62 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.438 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -98.21 113.35 25.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.333 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . 0.464 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 94.2 m-85 -112.21 122.59 48.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.696 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.555 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 30.5 tttm -124.99 130.29 52.06 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.17 35.83 18.31 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.472 0.482 . . . . 10.0 110.488 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 68.94 12.43 8.62 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.212 -0.904 . . . . 10.0 112.908 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . 0.52 HE22 ' HE1' ' B' ' 93' ' ' PHE . 29.5 mm-40 -129.12 157.29 42.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.884 0.373 . . . . 10.0 111.496 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.0 tp -80.35 143.35 33.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.405 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 46' ' ' LYS . 93.6 mt -93.05 156.68 16.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.243 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.434 ' OD2' ' HG3' ' B' ' 55' ' ' LYS . 15.2 t0 -92.98 119.88 32.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.788 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -57.57 -31.89 66.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.056 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.01 -3.74 90.64 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.611 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.434 ' HG3' ' OD2' ' B' ' 52' ' ' ASP . 41.3 mttp -101.1 153.72 19.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.47 . . . . 10.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.772 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.8 p -88.4 167.97 13.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.197 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.494 HD21 HD11 ' B' ' 27' ' ' LEU . 67.8 mt -60.49 -42.83 97.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 10.0 110.74 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.44 -41.52 98.62 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.622 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.24 -29.29 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.312 . . . . 10.0 111.686 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.7 m -79.85 -5.73 56.03 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.93 10.03 41.11 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.584 -0.817 . . . . 10.0 113.312 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 52.7 m-85 -79.96 67.39 5.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.179 0.514 . . . . 10.0 110.828 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.51 155.16 23.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.053 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -26.32 63.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.0 0.428 . . . . 10.0 111.728 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.11 -26.51 64.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.399 . . . . 10.0 110.917 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.69 -51.91 4.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.616 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.613 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -89.45 95.86 10.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.502 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -109.8 156.14 40.33 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.084 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.26 -14.36 37.55 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.306 2.004 . . . . 10.0 110.407 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.44 -7.4 21.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.995 -1.002 . . . . 10.0 109.956 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.5 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.87 88.61 1.69 Allowed Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.363 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.579 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 9.0 Cg_exo -74.25 147.74 37.91 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.732 2.288 . . . . 10.0 111.58 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.86 110.27 10.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.999 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.59 119.37 14.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.715 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.407 ' HB ' HD13 ' B' ' 7' ' ' ILE . 41.4 t -115.7 134.83 57.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.72 126.61 7.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.479 -0.867 . . . . 10.0 112.169 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.444 ' HB2' HG23 ' B' ' 7' ' ' ILE . 23.6 tp -111.12 105.6 14.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.908 0.385 . . . . 10.0 111.049 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.64 124.72 50.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.651 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -95.77 119.0 33.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.797 0.332 . . . . 10.0 110.116 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 18.9 ttp180 -79.66 78.8 6.2 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.923 -0.581 . . . . 10.0 111.099 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -98.52 129.65 45.09 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.692 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -68.18 150.08 48.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.988 -0.551 . . . . 10.0 109.768 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 70.11 7.62 6.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.561 0.538 . . . . 10.0 110.832 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 86' ' ' GLU . 7.0 m -123.12 132.89 54.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.141 -179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -100.46 -4.26 29.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.43 . . . . 10.0 111.011 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.489 ' H ' HG22 ' B' ' 84' ' ' THR . 37.4 tt0 -62.05 -24.63 67.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.686 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.98 74.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.871 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.65 -14.38 60.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.807 0.336 . . . . 10.0 111.666 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 51.2 m -84.18 -28.31 27.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.134 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.658 HG12 ' HB2' ' B' ' 10' ' ' HIS . 22.6 mt -94.51 -25.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.531 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.464 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 43.2 tt0 -69.41 112.63 12.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.67 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' B' ' 95' ' ' SER . 14.4 Cg_exo -72.0 -10.95 26.84 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.262 2.642 . . . . 10.0 111.416 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.52 ' HE1' HE22 ' B' ' 49' ' ' GLN . 54.6 t80 -74.85 -33.17 62.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.243 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -102.51 -40.17 6.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.549 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.603 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 6.8 m -119.43 142.63 32.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.535 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.38 152.97 80.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.765 2.31 . . . . 10.0 111.99 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.43 126.35 22.18 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.084 2.522 . . . . 10.0 112.193 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -66.14 112.71 4.04 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.787 -0.642 . . . . 10.0 111.77 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 32.2 tp -139.34 120.57 9.77 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.498 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.84 128.59 31.08 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.069 2.513 . . . . 10.0 112.076 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -59.62 -31.78 69.81 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.949 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.455 ' HB ' HG12 ' A' ' 29' ' ' VAL . 19.3 m -71.03 -17.55 20.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.19 0.519 . . . . 10.0 111.338 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.418 ' HG2' HG23 ' B' ' 102' ' ' VAL . 81.0 mmm -122.56 58.29 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.054 -0.721 . . . . 10.0 109.054 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.664 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 23.4 ttpt -135.02 -54.48 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.492 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -75.55 60.36 5.81 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.612 2.208 . . . . 10.0 112.218 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -123.44 -156.68 0.72 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.157 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.579 ' HB2' HE22 ' B' ' 118' ' ' GLN . 16.4 t0 -113.15 172.53 6.89 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.923 -0.311 . . . . 10.0 110.443 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 15.9 m -99.97 136.28 40.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.058 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -87.34 -144.99 9.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.563 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -35.95 11.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.925 0.393 . . . . 10.0 110.655 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.597 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 49.9 m -80.59 158.37 25.75 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.382 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . 0.409 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.65 123.71 20.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.908 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 73.17 5.6 5.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.761 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.597 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 45.6 tt0 -71.6 131.5 43.3 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.617 -0.512 . . . . 10.0 109.617 179.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -110.36 138.93 46.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.077 0.465 . . . . 10.0 111.529 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -108.88 111.21 22.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.807 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.575 ' H ' HD11 ' C' ' 81' ' ' ILE . 2.6 t -81.17 123.94 38.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.754 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.579 HE22 ' HB2' ' B' ' 107' ' ' ASP . 24.0 mp0 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.176 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.147 0.498 . . . . 10.0 110.798 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.938 ' HE3' ' HB3' ' C' ' 10' ' ' GLU . 75.6 tttt -108.88 122.83 48.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.91 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.496 HD22 ' HE2' ' C' ' 44' ' ' PHE . 25.1 mt -101.32 120.46 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.534 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.693 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.6 mt -105.65 115.81 48.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -87.13 173.69 9.09 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.919 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.9 m -68.17 -21.19 64.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.244 0.545 . . . . 10.0 110.704 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.81 -8.4 56.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.685 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.41 12.09 73.71 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.573 -0.822 . . . . 10.0 111.461 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . 0.404 ' CE1' ' HA ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -81.04 134.46 35.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.938 ' HB3' ' HE3' ' C' ' 2' ' ' LYS . 6.7 mt-10 -103.56 106.93 17.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.265 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -98.31 109.99 22.65 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.714 0.292 . . . . 10.0 111.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.593 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 14.6 mm -94.38 112.81 27.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.1 t -100.39 133.74 42.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.718 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.895 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 76.6 tttt -59.3 128.64 38.12 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -53.88 -35.19 61.3 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.239 0.337 . . . . 10.0 111.674 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -56.74 -40.28 75.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.145 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -86.32 -33.33 20.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.066 0.46 . . . . 10.0 110.084 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.86 -40.04 93.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.344 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.34 -47.18 86.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.309 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.442 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.0 OUTLIER -65.32 -40.06 93.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.691 179.495 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.9 m -65.29 -36.72 84.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.167 0.508 . . . . 10.0 109.824 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.27 -6.58 86.46 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.268 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 26.4 m -79.12 -27.33 42.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -83.38 143.32 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.771 -0.825 . . . . 10.0 108.771 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -66.49 95.42 0.32 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.088 0.471 . . . . 10.0 111.317 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -98.85 -171.3 2.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.144 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.525 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.8 mmm -79.59 31.81 0.24 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.847 0.356 . . . . 10.0 111.952 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 16.3 tp -66.17 -39.23 89.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.316 0.579 . . . . 10.0 110.016 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.51 7.04 24.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.593 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.95 -64.72 3.71 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.655 -0.702 . . . . 10.0 112.583 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.99 173.4 8.39 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.473 2.116 . . . . 10.0 111.666 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.96 -63.64 5.14 Favored Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.968 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -140.04 125.02 18.5 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.892 0.377 . . . . 10.0 110.134 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -88.25 110.16 20.51 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.287 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.5 152.82 28.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.218 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . 0.515 ' H ' ' HG3' ' C' ' 36' ' ' GLU . 1.5 mt-10 -62.33 -33.93 75.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.231 0.539 . . . . 10.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.58 -35.78 78.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.34 -0.846 . . . . 10.0 109.545 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.4 ' O ' HG22 ' C' ' 42' ' ' VAL . 41.7 tp10 -77.36 -22.84 51.12 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.452 -0.795 . . . . 10.0 110.023 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -73.86 -34.31 64.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.19 0.519 . . . . 10.0 109.739 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -70.73 -47.26 60.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.756 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.693 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.5 mt-10 -133.0 97.22 3.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.743 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.4 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.5 t -83.11 125.77 40.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.07 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -94.14 111.34 23.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.935 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.496 ' HE2' HD22 ' C' ' 3' ' ' LEU . 64.7 m-85 -102.08 110.7 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.399 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -101.06 144.9 29.42 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.799 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 69.71 22.7 6.02 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.86 0.725 . . . . 10.0 110.491 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 76.6 mt -131.51 107.21 14.43 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.335 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -64.72 156.64 60.38 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 123.069 2.513 . . . . 10.0 112.249 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.6 p -69.12 -34.89 75.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.577 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -35.77 76.47 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.688 0.625 . . . . 10.0 112.688 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.436 ' O ' HG23 ' C' ' 55' ' ' VAL . 32.9 m -87.37 -31.37 5.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.401 -0.52 . . . . 10.0 111.209 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.68 -33.89 75.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.277 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -40.59 98.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.823 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . 0.491 ' HE2' ' HB ' ' C' ' 81' ' ' ILE . 60.0 tttp -64.49 -37.97 89.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.436 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.0 t -63.83 -46.25 94.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.83 -43.19 98.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.852 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.16 -38.78 91.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.874 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.596 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 83.5 t80 -64.6 -42.88 95.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.4 -0.364 . . . . 10.0 110.525 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.476 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.5 m-85 -62.37 -44.86 95.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.011 -0.541 . . . . 10.0 109.912 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 29.1 m -60.0 -43.3 95.28 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.992 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -63.65 -42.17 98.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.173 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 12.6 tptt -64.3 -37.27 86.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.131 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.476 HG23 ' O ' ' C' ' 59' ' ' PHE . 55.6 t -60.28 -50.31 80.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.8 mmt180 -70.78 -31.27 67.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.442 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -62.52 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.091 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -75.7 -15.94 60.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.966 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.04 -55.77 4.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.945 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.5 p -145.95 -34.31 0.31 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.693 0.627 . . . . 10.0 112.693 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.469 ' O ' HG12 ' C' ' 72' ' ' ILE . 9.8 m -78.4 44.4 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.106 0.479 . . . . 10.0 112.216 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -18.35 26.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.552 0.691 . . . . 10.0 109.796 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . 0.466 ' H ' ' HG2' ' C' ' 71' ' ' GLU . 1.6 pt-20 -89.1 8.46 29.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.513 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.469 HG12 ' O ' ' C' ' 69' ' ' SER . 18.0 pt -111.21 163.92 16.2 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.14 149.9 82.34 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.466 2.111 . . . . 10.0 112.676 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -70.66 165.45 22.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.413 -0.812 . . . . 10.0 109.32 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -45.31 128.66 5.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.285 0.365 . . . . 10.0 111.151 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.76 5.4 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.077 2.518 . . . . 10.0 112.482 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 16' ' ' LEU . 7.2 pt -79.54 57.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.5 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -118.8 -55.22 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.483 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 39.6 Cg_exo -58.47 107.59 0.34 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.987 1.791 . . . . 10.0 112.187 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -72.61 57.02 0.4 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.761 -0.654 . . . . 10.0 112.6 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . 0.575 HD11 ' H ' ' B' ' 117' ' ' VAL . 8.1 mm -125.24 -4.35 5.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.348 0.594 . . . . 10.0 109.919 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.68 -43.7 68.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.566 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 29.8 tp -67.1 -29.9 69.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.379 0.609 . . . . 10.0 109.425 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.481 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 12.3 mp0 -64.23 -34.74 78.8 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.459 178.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.649 ' HB3' HD21 ' A' ' 8' ' ' LEU . 89.4 mt -76.47 -27.82 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.265 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.459 HD12 HD12 ' C' ' 83' ' ' LEU . 94.6 mt -73.06 -15.69 61.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.776 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 51.9 ttp -61.91 -26.12 67.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.695 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.69 83.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.76 -58.21 0.44 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.902 0.751 . . . . 10.0 112.59 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -82.65 50.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.516 0.674 . . . . 10.0 110.337 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.519 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.87 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.644 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.76 -0.136 . . . . 10.0 112.76 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -68.63 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.69 0.626 . . . . 10.0 112.69 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.517 HD22 ' HD2' ' C' ' 91' ' ' PHE . 4.3 mp -66.3 -21.67 66.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.785 0.291 . . . . 10.0 111.785 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -51.73 -31.96 28.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.335 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -115.49 -35.0 4.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.007 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.506 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.1 mt -63.0 -36.07 82.34 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.546 0.573 . . . . 10.0 112.546 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.54 72.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.682 0.277 . . . . 10.0 111.257 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.1 tp -68.31 -32.04 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.162 0.506 . . . . 10.0 110.667 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.07 -18.1 50.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.741 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 -11.68 29.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.055 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.558 ' HA ' HG22 ' C' ' 77' ' ' ILE . 12.7 tp -165.21 113.56 1.02 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.221 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.8 mt -90.14 78.72 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HD2' ' HB3' ' C' ' 80' ' ' GLU . 71.0 tttt -107.37 102.55 44.58 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.643 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -91.99 53.1 0.69 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.946 2.431 . . . . 10.0 111.697 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -100.63 -177.15 3.4 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.918 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -86.77 152.7 22.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.767 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.444 HG23 HD22 ' A' ' 32' ' ' LEU . 29.8 mm -120.49 105.92 17.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.679 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.002 ' HG2' ' HD2' ' A' ' 24' ' ' PRO . 4.4 tttp -120.2 146.23 42.03 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 1.002 ' HD2' ' HG2' ' A' ' 23' ' ' LYS . 33.1 Cg_exo -32.87 133.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 124.227 3.285 . . . . 10.0 113.5 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.792 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 31.0 Cg_endo -62.24 155.27 57.73 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 123.216 2.611 . . . . 10.0 113.401 -178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 122.96 63.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.477 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.78 -16.11 51.27 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.457 2.771 . . . . 10.0 112.893 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -42.26 98.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 10.0 110.121 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.4 t -120.99 -113.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.709 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG2' HG12 ' A' ' 29' ' ' VAL . 5.7 ptp180 -171.9 57.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.062 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.46 ' HG3' ' HG2' ' C' ' 84' ' ' GLU . 20.3 tttm -152.8 151.92 31.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.134 -179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.792 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.8 pp -72.0 156.28 39.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.683 0.277 . . . . 10.0 110.977 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 m -96.43 161.82 13.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.475 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -101.69 124.95 48.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.657 -0.498 . . . . 10.0 109.657 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.654 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 9.5 t70 -174.91 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.109 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.7 -64.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.516 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.0 m0 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.141 -0.933 . . . . 10.0 109.281 179.796 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmm . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 120.831 0.348 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -177.93 104.1 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.657 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.508 HG11 HD13 ' B' ' 57' ' ' LEU . 55.5 t -119.56 123.66 71.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.282 0.563 . . . . 10.0 111.78 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.01 116.67 31.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.237 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.656 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.5 OUTLIER -126.65 151.33 48.2 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.182 0.515 . . . . 10.0 112.326 -179.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.534 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 41.7 mtm -122.3 104.58 9.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.137 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.48 HD11 HD12 ' B' ' 5' ' ' LEU . 44.7 mm -81.75 104.24 10.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.58 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.4 ttt180 -101.54 104.31 15.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 28.0 ttp85 -91.93 69.79 5.48 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.493 ' CE1' ' HE2' ' B' ' 11' ' ' LYS . 6.7 t-160 66.98 -79.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.343 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.493 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 71.1 mmtt -110.03 -11.29 14.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.643 0.259 . . . . 10.0 111.345 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 102.93 12.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.646 -0.252 . . . . 10.0 110.887 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 17.8 m -101.72 124.29 47.12 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.872 0.368 . . . . 10.0 110.914 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.452 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.1 mt -116.41 122.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.365 -0.38 . . . . 10.0 110.987 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -84.66 122.65 29.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.851 0.358 . . . . 10.0 110.144 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.656 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -117.96 130.17 56.05 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.491 . . . . 10.0 111.634 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -110.74 103.89 12.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -130.97 -168.65 2.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.453 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -129.49 161.22 30.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 3.8 mp0 -54.26 -28.13 39.56 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.5 m -68.08 -25.43 65.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.46 0.541 . . . . 10.0 112.46 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.4 m -73.24 137.4 44.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.619 0.247 . . . . 10.0 110.81 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 73.6 p -87.98 167.28 13.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.875 0.369 . . . . 10.0 111.181 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.751 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 70.7 t -65.1 -35.53 75.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.102 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . 0.672 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 52.5 t80 -62.19 -34.96 77.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.172 0.51 . . . . 10.0 110.517 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.406 ' O ' HG13 ' B' ' 30' ' ' ILE . 34.1 mt-10 -66.38 -31.17 71.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.847 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.917 HD11 HD21 ' B' ' 57' ' ' LEU . 63.8 mt -66.32 -43.98 84.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 10.0 109.949 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -61.07 -34.66 75.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -67.96 -32.96 73.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.447 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.406 HG13 ' O ' ' B' ' 26' ' ' GLU . 82.7 mt -69.5 -46.69 75.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.114 -0.699 . . . . 10.0 109.114 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -63.48 -35.07 71.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.542 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.6 tm-20 -60.53 -38.03 83.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.291 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.15 1.05 71.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.729 -0.748 . . . . 10.0 112.946 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.56 -56.05 4.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.891 0.377 . . . . 10.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.75 -13.72 44.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.503 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 90.9 mttt 61.7 31.64 18.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.728 -0.669 . . . . 10.0 112.166 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -105.04 142.86 25.53 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.654 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.16 125.22 17.48 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.893 2.395 . . . . 10.0 112.496 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.542 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 30.5 Cg_endo -64.11 -21.36 67.91 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.953 2.435 . . . . 10.0 112.322 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.31 -29.75 70.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -96.11 -4.07 43.47 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.78 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.9 135.19 35.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.935 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.486 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 80.8 mmt-85 -127.14 110.21 12.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.81 111.66 23.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.904 0.383 . . . . 10.0 110.661 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -107.44 109.95 21.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.758 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.483 ' HB3' HD21 ' B' ' 51' ' ' LEU . 7.8 tttt -118.52 134.01 55.42 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.947 -1.131 . . . . 10.0 107.947 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 62.35 32.0 17.1 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.253 0.549 . . . . 10.0 109.715 -178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 67.93 10.54 7.87 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.021 -0.991 . . . . 10.0 112.066 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -124.59 151.37 44.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.017 0.437 . . . . 10.0 111.303 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 27.8 tp -74.83 126.44 30.95 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.185 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.549 ' HB3' HG21 ' B' ' 24' ' ' VAL . 89.4 mt -72.48 153.54 41.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.899 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -93.1 112.34 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.961 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.751 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.7 m-20 -60.31 -27.24 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.137 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.66 -12.79 83.25 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.942 -0.647 . . . . 10.0 112.714 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -102.27 161.49 13.66 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.876 0.369 . . . . 10.0 111.038 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.848 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.6 p -90.97 172.9 8.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.885 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.917 HD21 HD11 ' B' ' 27' ' ' LEU . 87.1 mt -62.39 -29.61 70.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.525 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.49 -43.96 98.63 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.131 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -75.08 -15.21 60.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.76 0.282 . . . . 10.0 111.76 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 53.5 m -95.84 15.35 20.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.825 0.345 . . . . 10.0 111.782 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.37 41.56 96.46 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.017 -0.611 . . . . 10.0 113.115 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.502 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 23.4 m-85 -101.97 48.62 0.87 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.002 0.43 . . . . 10.0 110.228 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.01 149.79 49.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.512 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -22.69 65.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.977 0.418 . . . . 10.0 111.717 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.2 mm-40 -72.81 -32.03 65.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.066 0.46 . . . . 10.0 110.418 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.81 -37.97 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.797 179.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.5 92.14 3.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.508 -0.769 . . . . 10.0 109.138 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' OE1' ' B' ' 70' ' ' GLN . 7.8 mtt180 -106.74 163.5 16.85 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.775 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 29.0 Cg_endo -65.23 -16.27 53.97 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.334 2.023 . . . . 10.0 111.2 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.412 ' OE1' ' HD2' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -107.34 1.28 23.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.613 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.515 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -161.8 82.84 1.79 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.577 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.534 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -74.88 143.43 29.48 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.923 2.416 . . . . 10.0 111.987 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.77 118.05 13.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.805 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.76 123.26 26.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.44 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.456 ' HB ' HD13 ' B' ' 7' ' ' ILE . 34.9 t -122.99 136.32 60.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.26 134.38 12.4 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.747 -0.74 . . . . 10.0 111.73 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.47 102.76 10.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.897 0.38 . . . . 10.0 111.838 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.486 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.43 130.74 38.02 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.818 -0.808 . . . . 10.0 108.818 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -111.59 116.48 30.89 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.629 0.252 . . . . 10.0 110.998 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -70.99 104.25 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.179 0.514 . . . . 10.0 111.005 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -122.01 126.97 49.72 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.804 -0.634 . . . . 10.0 109.367 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -66.29 133.27 50.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.953 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 22.8 t70 76.26 -22.38 0.28 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.265 0.839 . . . . 10.0 113.265 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.4 m -85.25 106.39 16.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.994 0.426 . . . . 10.0 110.429 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -77.51 -4.36 45.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.163 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -60.07 -30.95 69.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.916 0.388 . . . . 10.0 110.897 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.54 -34.2 66.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.964 -0.562 . . . . 10.0 112.471 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.76 -30.04 69.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.4 m -79.6 -12.35 59.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.701 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 mt -100.29 -0.85 10.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 10.0 111.098 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 32.9 tt0 -97.81 110.89 57.36 Favored Pre-proline 0 C--N 1.323 -0.553 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -70.73 2.49 4.02 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.257 2.638 . . . . 10.0 112.383 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.553 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 19.0 t80 -94.1 -18.67 21.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.213 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.4 p -118.94 -42.11 2.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.165 179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 15.3 m -106.52 153.33 40.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.991 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.04 159.09 23.91 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.382 2.055 . . . . 10.0 111.366 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.66 126.23 20.01 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.585 2.19 . . . . 10.0 111.591 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -70.99 103.81 2.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.505 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 30.6 tp -131.38 126.54 21.33 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.447 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.646 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 51.1 Cg_exo -54.67 134.07 60.4 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.819 2.346 . . . . 10.0 111.768 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.01 -37.64 88.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.272 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.6 m -73.51 -15.95 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.324 0.583 . . . . 10.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.646 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 89.7 mmm -112.78 39.14 2.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.65 -0.704 . . . . 10.0 109.508 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.63 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 28.2 ttpt -115.76 -53.74 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.169 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 9.9 Cg_exo -73.11 69.77 3.85 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 122.314 2.01 . . . . 10.0 111.553 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 58.2 mt-30 -137.1 170.68 15.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.608 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 4.7 t0 -85.63 175.54 8.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.785 0.326 . . . . 10.0 110.794 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.3 m -96.63 143.65 27.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.348 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . 0.5 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -92.18 -153.21 29.67 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.213 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -33.73 13.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.212 0.529 . . . . 10.0 110.877 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.515 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 50.8 m -89.09 163.41 15.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.879 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.61 132.13 45.72 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.041 -0.725 . . . . 10.0 109.041 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.85 -0.28 3.41 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.709 0.63 . . . . 10.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.5 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 35.7 tt0 -76.49 131.61 39.11 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -115.48 151.33 34.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.053 0.454 . . . . 10.0 111.365 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -118.21 106.02 12.38 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.046 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.623 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -69.52 127.86 32.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.809 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' B' ' 106' ' ' GLN . 11.6 mp0 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.077 -0.511 . . . . 10.0 111.412 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.134 0.492 . . . . 10.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.68 ' HE2' HG12 ' C' ' 4' ' ' ILE . 61.5 tttt -105.42 121.93 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.586 -0.734 . . . . 10.0 110.847 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.632 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 39.1 mt -95.7 115.06 26.88 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.724 HD11 ' HB3' ' C' ' 41' ' ' GLU . 3.9 mt -98.7 109.78 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.5 p -83.33 170.82 14.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.73 0.3 . . . . 10.0 110.975 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 4.1 m -67.84 -19.8 65.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.886 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -82.91 -4.87 58.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.079 0.466 . . . . 10.0 110.296 179.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.22 65.57 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.406 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.96 130.49 34.53 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -95.17 117.16 29.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.238 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.632 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 87.9 m-85 -108.25 106.47 16.65 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.686 0.279 . . . . 10.0 110.882 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.452 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.3 mm -94.34 116.54 35.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.63 136.17 43.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.591 0.234 . . . . 10.0 110.88 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -58.62 129.37 41.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 26.9 ttt180 -57.94 -25.53 61.04 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 112.683 0.623 . . . . 10.0 112.683 -178.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -55.17 -49.81 70.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.198 0.523 . . . . 10.0 110.149 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -77.95 -32.14 51.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.864 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -63.06 -37.22 86.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 10.0 111.342 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 64.8 mt -59.98 -52.4 65.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.978 0.418 . . . . 10.0 110.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.47 ' HB ' HG22 ' C' ' 63' ' ' VAL . 1.7 m -62.1 -44.21 97.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 19.6 m -62.1 -38.78 90.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.996 0.427 . . . . 10.0 110.848 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.29 -10.11 78.16 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.066 -0.588 . . . . 10.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 23.6 m -86.5 -25.17 25.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.249 0.547 . . . . 10.0 109.582 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . 0.556 HG22 ' H ' ' C' ' 25' ' ' LYS . 6.5 mt -75.1 170.61 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.883 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . 0.556 ' H ' HG22 ' C' ' 24' ' ' ILE . 31.8 tttp -73.29 78.33 1.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 10.0 110.681 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -94.58 170.14 9.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.796 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.644 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 87.3 mmm -80.31 45.18 0.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.712 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 tt -70.24 -37.5 74.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.045 0.45 . . . . 10.0 110.233 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.73 12.91 13.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.841 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.3 -60.97 6.13 Favored Glycine 0 CA--C 1.523 0.537 0 CA-C-N 115.789 -0.641 . . . . 10.0 113.027 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -67.91 -178.31 1.61 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.621 2.214 . . . . 10.0 112.253 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.3 -49.08 68.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.891 -0.671 . . . . 10.0 112.158 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -149.69 133.38 16.81 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.586 -0.524 . . . . 10.0 109.586 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.23 100.8 12.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.032 0.444 . . . . 10.0 110.352 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.48 159.13 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.042 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.3 -28.59 63.19 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -61.83 -42.54 99.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.046 0.45 . . . . 10.0 110.083 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.492 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.2 tp10 -72.8 -20.29 61.18 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -79.78 -32.0 40.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.209 0.528 . . . . 10.0 109.621 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -75.04 -51.05 14.51 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.724 ' HB3' HD11 ' C' ' 4' ' ' ILE . 35.7 mt-10 -131.55 106.63 8.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.76 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.492 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.3 t -92.82 115.07 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.535 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -90.15 113.75 25.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.979 0.419 . . . . 10.0 111.176 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.56 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.4 m-85 -102.26 103.13 13.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -92.35 148.44 22.13 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 69.1 17.57 8.45 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.808 0.693 . . . . 10.0 110.716 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.436 HD12 ' HB3' ' C' ' 44' ' ' PHE . 77.8 mt -129.84 108.17 16.91 Favored Pre-proline 0 C--O 1.237 0.425 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.793 -179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -63.33 149.39 91.36 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.069 2.512 . . . . 10.0 112.504 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 6.4 p -62.77 -40.07 96.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.576 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.72 -53.15 58.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 10.0 112.257 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.431 ' O ' HG23 ' C' ' 55' ' ' VAL . 34.2 m -68.21 -34.47 66.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.904 -0.319 . . . . 10.0 111.217 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.17 -30.8 71.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.946 0.403 . . . . 10.0 110.332 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -62.97 -40.57 98.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.499 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -68.1 -35.13 77.66 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.284 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.431 HG23 ' O ' ' C' ' 51' ' ' VAL . 61.4 t -63.18 -46.32 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.619 179.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.31 -41.59 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.902 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 63.3 mtm -65.66 -40.76 92.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.914 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.506 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.6 t80 -64.28 -42.22 96.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.603 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.42 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.3 m-85 -62.94 -44.5 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.278 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 43.4 m -58.88 -43.09 90.86 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.488 0.661 . . . . 10.0 109.794 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.59 -43.43 84.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.117 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -61.42 -39.68 91.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.362 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.47 HG22 ' HB ' ' C' ' 20' ' ' THR . 46.4 t -60.43 -45.03 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.416 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -77.31 -38.83 49.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.72 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.587 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -55.21 -52.39 63.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.044 0.45 . . . . 10.0 110.491 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.7 50.59 1.92 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.599 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -158.56 -54.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.438 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -139.77 -38.08 0.48 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.279 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.587 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -80.06 40.18 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.917 0.389 . . . . 10.0 111.769 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.7 -8.03 56.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.291 0.567 . . . . 10.0 110.244 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -79.72 -27.71 40.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.149 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.674 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 27.5 pt -92.22 165.3 20.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.842 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.674 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 70.4 Cg_endo -73.68 -178.33 3.68 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.329 2.019 . . . . 10.0 113.422 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -78.58 173.37 12.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.32 -0.854 . . . . 10.0 108.907 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.31 129.77 51.64 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 123.104 0.252 . . . . 10.0 110.445 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.3 123.02 10.35 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.121 2.548 . . . . 10.0 112.534 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.558 HG22 ' HA ' ' A' ' 16' ' ' LEU . 23.0 pt -82.09 38.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.494 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.468 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -92.57 -57.03 0.24 Allowed Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 10.0 112.081 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 37.8 Cg_endo -66.78 103.48 0.71 Allowed 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.119 1.879 . . . . 10.0 111.189 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.648 ' HB3' ' HD2' ' A' ' 18' ' ' LYS . 26.4 mt-10 -76.71 51.93 0.79 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.708 0.633 . . . . 10.0 112.708 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 27.8 mm -118.34 -9.18 11.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.479 0.657 . . . . 10.0 110.096 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -70.3 -29.31 66.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.255 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.483 HD22 ' HG2' ' A' ' 18' ' ' LYS . 11.6 tp -73.25 -26.14 60.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.181 0.515 . . . . 10.0 110.165 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.498 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 5.4 mp0 -63.7 -27.36 69.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.715 179.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.433 ' HB3' HD23 ' A' ' 8' ' ' LEU . 43.1 mt -76.85 -23.87 52.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.897 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 53.1 tp -72.53 -12.63 61.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.516 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 48.3 ttp -62.53 -29.13 70.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.983 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.54 78.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.687 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.81 -51.36 0.68 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.934 0.716 . . . . 10.0 112.934 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -83.76 34.32 0.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.221 0.534 . . . . 10.0 110.773 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.517 ' HD2' HD22 ' A' ' 8' ' ' LEU . 4.1 t80 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.517 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 112.102 -0.399 . . . . 10.0 112.102 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.572 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.73 -61.37 2.23 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.52 0.563 . . . . 10.0 112.52 -179.063 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.549 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.5 tp -63.6 -30.65 71.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.42 -0.355 . . . . 10.0 111.348 -178.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.41 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 11.8 tt0 -56.7 -26.29 56.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.926 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -106.79 -38.64 6.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.443 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.5 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 62.3 mt -59.6 -39.87 85.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.942 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.06 -38.44 72.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.328 . . . . 10.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.38 -34.25 76.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.102 0.477 . . . . 10.0 110.785 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.9 0.74 46.54 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.924 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.47 -48.06 3.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.162 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.768 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.1 OUTLIER -140.08 110.02 6.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.89 -179.697 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.8 mt -76.17 114.89 16.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.702 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.812 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 53.2 tttt -126.6 92.03 45.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.873 0.368 . . . . 10.0 110.839 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -83.26 48.52 2.71 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.952 2.434 . . . . 10.0 111.979 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 54.3 mttt -93.15 -170.03 2.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.03 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -96.55 168.4 10.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.02 0.438 . . . . 10.0 111.612 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.0 mm -111.97 151.04 14.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.173 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.932 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -175.28 138.88 0.58 Allowed Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.49 -0.929 . . . . 10.0 108.49 179.213 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.596 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 53.3 Cg_exo -40.4 137.74 1.46 Allowed 'Trans proline' 0 C--O 1.239 0.566 0 C-N-CA 123.354 2.702 . . . . 10.0 113.058 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.4 Cg_endo -60.57 136.0 64.4 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.044 2.496 . . . . 10.0 112.059 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 31' ' ' LYS . 0.3 OUTLIER -76.18 123.65 88.05 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.643 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -68.0 -7.65 20.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.001 2.467 . . . . 10.0 112.466 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -36.6 78.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 10.0 111.034 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.571 HG12 ' HG2' ' A' ' 30' ' ' ARG . 2.1 t -132.88 -113.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.724 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.571 ' HG2' HG12 ' A' ' 29' ' ' VAL . 3.8 ptp180 -162.16 56.14 0.24 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.211 0.529 . . . . 10.0 110.912 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 tttm -151.57 155.19 37.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.863 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 1.1 pp -84.55 151.69 24.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.705 -0.479 . . . . 10.0 109.705 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HD2' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -86.97 175.92 7.9 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.633 -0.258 . . . . 10.0 110.386 -179.592 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 0.8 OUTLIER -124.47 119.53 29.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.652 0.263 . . . . 10.0 110.845 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.932 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -165.93 -70.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.269 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 175.37 -56.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.454 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.414 ' SD ' ' HD2' ' B' ' 19' ' ' LYS . 9.0 tmm? . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.831 0.348 . . . . 10.0 110.708 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.25 141.91 30.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.826 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.549 ' CG2' ' HG3' ' B' ' 20' ' ' GLU . 76.4 t -128.8 126.78 65.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.128 0.489 . . . . 10.0 110.826 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.405 ' O ' ' HB1' ' B' ' 67' ' ' ALA . 54.4 m-85 -116.39 118.04 31.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.888 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.862 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -131.37 160.75 34.14 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.692 0.282 . . . . 10.0 111.13 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.629 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 58.1 mtm -127.83 108.63 10.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.863 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.599 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.9 mm -82.26 102.71 8.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 67.5 ttt180 -100.51 105.18 16.6 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.534 0.568 . . . . 10.0 112.534 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.541 ' HB2' HD23 ' B' ' 77' ' ' LEU . 20.6 ttp85 -94.14 82.67 4.17 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.959 -1.497 . . . . 10.0 106.959 177.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.538 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.2 t-80 66.79 -86.15 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.204 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -119.65 6.88 11.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.151 0.5 . . . . 10.0 111.102 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -105.86 95.19 5.62 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.239 -0.652 . . . . 10.0 109.239 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 6.4 m -95.09 117.13 29.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.016 0.436 . . . . 10.0 110.943 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.548 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 52.8 mt -108.17 117.23 53.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.555 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -74.04 116.68 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.862 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.3 m -107.7 114.22 28.04 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.234 0.54 . . . . 10.0 111.511 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.901 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 1.4 t70 -103.49 110.6 22.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.033 -1.099 . . . . 10.0 108.033 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -141.14 -159.78 1.0 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.979 0.419 . . . . 10.0 111.937 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.414 ' HD2' ' SD ' ' B' ' 1' ' ' MET . 38.0 mmtm -129.86 161.27 31.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.344 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.549 ' HG3' ' CG2' ' B' ' 3' ' ' VAL . 14.1 mt-10 -61.56 -24.49 66.68 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.663 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -16.61 59.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.303 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.469 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 19.2 m -76.04 144.03 41.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.501 0.191 . . . . 10.0 111.015 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 37.9 p -90.15 168.17 12.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.829 0.347 . . . . 10.0 111.042 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.401 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 79.4 t -67.42 -35.59 73.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.852 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . 0.529 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 69.2 t80 -63.57 -32.81 74.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.1 0.476 . . . . 10.0 110.515 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.71 -34.08 77.46 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.417 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.726 HD11 HD21 ' B' ' 57' ' ' LEU . 69.9 mt -63.38 -44.65 94.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -62.1 -35.06 77.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.529 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -66.76 -34.38 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.222 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 85.8 mt -71.18 -45.55 70.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.55 -36.26 72.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.085 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -59.89 -39.82 86.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.66 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.64 -10.17 84.77 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.67 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 79.5 mt -103.04 -51.75 8.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 111.755 0.28 . . . . 10.0 111.755 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 58.5 mt -89.15 -13.06 39.28 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 57.83 43.5 21.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.399 0.618 . . . . 10.0 112.021 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -127.22 140.68 38.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.259 -0.882 . . . . 10.0 110.033 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -48.99 119.98 4.97 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.403 2.735 . . . . 10.0 112.986 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.72 -16.87 42.43 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.113 2.542 . . . . 10.0 112.258 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.71 -32.78 74.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.567 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -100.74 11.29 39.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 10.0 111.823 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -90.58 126.99 36.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' B' ' 43' ' ' ARG . 37.4 mmt-85 -110.98 123.31 49.93 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.3 121.49 45.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.431 -0.349 . . . . 10.0 110.622 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -119.97 129.84 54.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.814 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.513 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.2 tttm -130.0 129.45 43.75 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.959 -0.756 . . . . 10.0 108.959 179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 64.93 25.98 12.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.011 0.434 . . . . 10.0 110.287 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 71.98 19.06 4.8 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.27 -0.877 . . . . 10.0 111.235 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -125.94 152.96 44.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.74 -0.663 . . . . 10.0 110.281 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -78.1 137.35 38.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.378 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' B' ' 46' ' ' LYS . 92.8 mt -85.98 165.22 16.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.191 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -112.07 121.18 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.684 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.529 ' HB3' ' HB2' ' B' ' 25' ' ' PHE . 44.7 m-20 -61.83 -28.99 69.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.203 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.98 -5.17 86.39 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.552 -0.832 . . . . 10.0 113.431 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -104.66 157.51 17.13 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.112 0.456 . . . . 10.0 111.433 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.75 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.0 p -89.25 165.14 14.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.613 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.726 HD21 HD11 ' B' ' 27' ' ' LEU . 45.8 mt -59.04 -42.48 90.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.313 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.35 -31.62 66.6 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.046 -0.597 . . . . 10.0 112.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -79.73 -23.73 42.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.028 0.442 . . . . 10.0 110.914 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 52.0 m -86.66 0.8 53.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.6 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.77 8.88 57.92 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.977 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.514 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 59.6 m-85 -80.6 98.51 7.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.888 0.375 . . . . 10.0 110.125 179.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.89 164.41 23.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.064 -0.717 . . . . 10.0 109.064 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.7 m -67.86 -10.94 57.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 10.0 112.048 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -77.93 -37.58 47.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.126 0.489 . . . . 10.0 110.066 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -48.08 6.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.774 -0.648 . . . . 10.0 109.852 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.405 ' HB1' ' O ' ' B' ' 4' ' ' PHE . . . -94.26 96.47 9.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.784 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 1.0 OUTLIER -107.34 161.14 24.02 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.547 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 30.1 Cg_endo -65.41 -15.86 51.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.478 2.119 . . . . 10.0 111.481 178.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.75 2.14 23.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.987 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.84 85.91 1.25 Allowed Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.576 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.629 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 11.1 Cg_exo -73.29 147.6 42.27 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.739 2.293 . . . . 10.0 111.334 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.97 116.23 11.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.02 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.74 117.13 11.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.443 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.599 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.5 t -117.01 133.68 62.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.67 128.7 9.24 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.657 -0.782 . . . . 10.0 112.409 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 9' ' ' ARG . 23.7 tp -113.11 114.35 26.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 10.0 111.022 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -112.95 124.61 53.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.657 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -100.5 113.58 26.48 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -77.32 112.74 14.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.963 0.411 . . . . 10.0 111.54 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -132.54 147.83 52.36 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.524 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 83' ' ' ASP . 32.0 t70 -71.46 139.62 49.71 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.07 -0.344 . . . . 10.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' B' ' 82' ' ' ASP . 19.4 t70 77.92 -31.0 0.16 Allowed 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.603 0.564 . . . . 10.0 112.224 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 1.9 m -83.3 95.11 8.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 10.0 111.059 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -74.23 -4.01 33.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.202 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.475 ' O ' HG13 ' B' ' 90' ' ' ILE . 35.4 tt0 -56.26 -32.44 64.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.663 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.07 76.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.209 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.2 mt -72.68 -18.76 61.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.978 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.15 -11.46 38.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.405 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.538 HG12 ' HB2' ' B' ' 10' ' ' HIS . 53.4 mt -101.44 -31.59 3.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.431 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.61 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 39.2 tt0 -66.03 114.15 15.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.742 -0.663 . . . . 10.0 111.484 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.516 ' HA ' ' O ' ' B' ' 95' ' ' SER . 8.4 Cg_exo -74.0 -0.65 9.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.1 2.533 . . . . 10.0 111.354 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.61 ' H ' ' HG2' ' B' ' 91' ' ' GLU . 12.7 t80 -86.66 -16.09 37.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.987 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.24 -42.88 2.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.859 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 10.5 m -113.23 150.49 43.1 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.83 154.95 66.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.593 2.195 . . . . 10.0 111.553 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.73 130.6 37.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.882 2.388 . . . . 10.0 112.496 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.97 102.22 1.95 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.909 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 24.7 tp -140.27 130.0 13.55 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.833 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.458 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 50.1 Cg_exo -56.41 131.77 47.75 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.992 2.461 . . . . 10.0 111.803 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . 0.983 ' HA ' ' HD3' ' B' ' 104' ' ' LYS . 27.6 t0 -65.6 -34.42 78.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.486 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -68.97 -20.36 24.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.286 0.565 . . . . 10.0 110.532 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.458 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 65.4 mmm -107.6 54.97 0.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.65 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.983 ' HD3' ' HA ' ' B' ' 101' ' ' ASP . 32.9 mtpt -133.62 -47.71 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.97 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.839 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 64.6 Cg_endo -72.95 45.23 0.88 Allowed 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.166 1.911 . . . . 10.0 113.493 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.845 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 8.6 mp0 -119.38 175.0 6.03 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.649 -0.501 . . . . 10.0 109.649 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -90.49 165.86 13.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.637 0.256 . . . . 10.0 110.379 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 50.7 m -89.99 143.85 26.42 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.211 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . 0.487 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -83.96 -150.75 11.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.259 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.26 -27.93 15.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.36 0.6 . . . . 10.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.924 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 0.7 OUTLIER -96.68 165.72 12.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.273 -0.876 . . . . 10.0 110.871 -179.347 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.79 138.18 46.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.612 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 68.52 4.79 4.47 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.823 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.487 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 34.9 tt0 -86.07 128.93 34.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -114.67 141.68 47.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.941 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.21 101.17 9.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.845 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 3.7 t -74.04 133.97 30.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.787 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.994 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.893 0.378 . . . . 10.0 110.923 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.435 ' HE2' HG12 ' C' ' 4' ' ' ILE . 44.9 tttt -108.84 113.8 27.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.961 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.531 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 26.2 mt -91.29 127.83 36.88 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.435 HG12 ' HE2' ' C' ' 2' ' ' LYS . 8.2 mt -113.14 120.61 63.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.489 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.3 p -94.31 166.52 12.04 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.126 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -1.24 11.83 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.198 0.444 . . . . 10.0 112.198 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -95.06 2.96 55.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.851 0.357 . . . . 10.0 110.216 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 74.06 33.54 57.0 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.78 -0.724 . . . . 10.0 111.433 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -108.65 128.4 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -97.02 121.67 39.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.896 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.531 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 81.7 m-85 -112.35 110.03 20.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.601 0.239 . . . . 10.0 110.585 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.548 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 21.6 mm -96.06 116.03 36.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.9 t -104.72 135.9 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.406 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.901 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 22.2 tttt -58.97 131.89 52.39 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 65.8 ttt180 -57.89 -34.86 70.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 10.0 112.013 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.436 ' HB2' ' HD3' ' C' ' 14' ' ' LYS . 31.3 mt-10 -56.78 -38.11 72.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.693 0.282 . . . . 10.0 111.411 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -82.96 -32.67 26.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.141 0.496 . . . . 10.0 110.083 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.82 -29.72 70.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.89 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.8 mt -59.29 -55.9 28.96 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.417 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.8 -40.1 96.32 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.283 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.0 m -62.2 -35.34 78.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.469 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.44 -18.18 79.95 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.092 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 14.0 m -79.76 -28.57 40.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.089 0.471 . . . . 10.0 109.765 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mt -74.53 149.76 7.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.158 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.61 113.47 6.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 10.0 110.414 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.572 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -134.06 177.57 7.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.871 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.517 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.4 mmm -78.87 38.06 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.894 0.378 . . . . 10.0 111.581 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -66.64 -37.73 85.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.23 0.538 . . . . 10.0 110.019 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 2.5 m -91.56 18.58 7.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.314 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -67.53 -60.55 5.74 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.671 -0.695 . . . . 10.0 112.834 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.84 172.02 7.71 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.356 2.038 . . . . 10.0 112.311 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.23 -55.18 27.74 Favored Glycine 0 C--N 1.331 0.252 0 CA-C-N 115.885 -0.598 . . . . 10.0 113.167 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -149.67 110.48 4.3 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.505 -0.409 . . . . 10.0 111.11 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -77.27 90.6 3.74 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.087 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.4 171.83 14.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.004 -0.543 . . . . 10.0 111.137 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -58.07 -33.59 69.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.143 -0.48 . . . . 10.0 111.329 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -60.85 -44.13 97.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.156 0.503 . . . . 10.0 109.85 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.431 ' O ' HG22 ' C' ' 42' ' ' VAL . 3.0 mp0 -72.6 -26.21 61.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.685 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 10.4 m -74.07 -35.41 64.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.248 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -76.48 -50.92 12.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.109 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.425 ' HB3' HD11 ' C' ' 4' ' ' ILE . 29.9 mt-10 -124.8 107.32 10.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.302 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.431 HG22 ' O ' ' C' ' 38' ' ' GLU . 3.4 t -92.89 103.66 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.972 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -90.14 119.48 30.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.977 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.609 ' HB3' HD12 ' C' ' 47' ' ' ILE . 87.1 m-85 -98.81 142.29 30.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.214 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -112.58 135.72 52.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.405 -0.362 . . . . 10.0 111.609 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 64.92 19.48 11.86 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.47 -0.786 . . . . 10.0 112.197 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.609 HD12 ' HB3' ' C' ' 44' ' ' PHE . 80.0 mt -114.74 107.46 50.57 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.396 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 45.2 Cg_exo -59.71 149.52 82.39 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 123.191 2.594 . . . . 10.0 112.377 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -65.01 -35.86 82.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.758 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -56.16 24.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.76 -0.654 . . . . 10.0 111.953 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.527 ' HB ' HD21 ' C' ' 85' ' ' LEU . 35.7 m -67.62 -33.3 61.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.354 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.63 -36.69 84.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 40.8 m -59.66 -38.04 80.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -67.11 -32.6 73.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.355 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.84 -46.76 78.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.5 m -59.84 -41.45 91.39 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.702 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 59.7 mtm -68.51 -39.32 81.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.787 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.5 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.0 t80 -63.07 -44.84 94.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.718 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.27 -44.99 95.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.397 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 57.8 m -58.73 -41.98 87.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.934 -0.575 . . . . 10.0 109.865 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -65.43 -47.41 76.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.914 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -59.04 -40.93 86.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.866 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 42.2 t -57.96 -50.23 78.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.625 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.7 mmt85 -72.07 -38.82 69.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.949 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.451 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 79.2 t80 -58.03 -42.37 85.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.111 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.47 19.94 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.005 0.431 . . . . 10.0 111.513 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -128.4 -44.66 1.38 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.803 0.335 . . . . 10.0 111.543 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.98 -38.67 0.27 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.956 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.521 ' O ' HG12 ' C' ' 72' ' ' ILE . 0.7 OUTLIER -79.68 41.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.868 0.322 . . . . 10.0 111.868 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.66 -18.96 33.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.329 0.585 . . . . 10.0 110.247 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -73.0 -14.62 61.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.952 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.555 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 17.1 pt -101.03 160.45 26.64 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.555 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 65.1 Cg_endo -73.93 175.27 11.05 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.318 2.012 . . . . 10.0 113.015 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.41 172.52 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.485 -0.78 . . . . 10.0 109.508 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -49.66 126.36 17.82 Favored Pre-proline 0 C--N 1.331 -0.233 0 C-N-CA 122.457 0.303 . . . . 10.0 110.528 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.28 122.77 8.04 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.295 2.664 . . . . 10.0 113.029 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.768 HG22 ' HA ' ' A' ' 16' ' ' LEU . 5.7 pt -76.58 59.77 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.752 -0.658 . . . . 10.0 112.341 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.714 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -112.96 -59.12 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.714 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 12.0 Cg_exo -71.56 106.84 2.04 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.159 1.906 . . . . 10.0 111.682 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.812 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 2.3 pt-20 -73.46 50.69 0.32 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.049 -0.523 . . . . 10.0 112.372 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 mm -110.17 19.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.71 0.767 . . . . 10.0 109.862 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.5 -42.43 18.45 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.062 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.35 -30.17 70.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.208 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.566 ' HA ' HD23 ' A' ' 32' ' ' LEU . 13.1 mp0 -59.7 -41.67 91.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.998 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.549 ' HB3' HD21 ' A' ' 8' ' ' LEU . 87.3 mt -78.77 -38.04 39.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.705 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 2.9 tt -61.44 -32.37 72.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.357 -0.838 . . . . 10.0 110.846 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 33.0 ttp -59.6 -19.85 51.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.989 -0.55 . . . . 10.0 112.083 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.46 -32.49 71.44 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.54 -58.89 0.42 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 124.021 0.826 . . . . 10.0 113.223 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -82.04 39.45 0.57 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.164 0.507 . . . . 10.0 111.025 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.678 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.492 -0.243 . . . . 10.0 112.492 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.564 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.69 -66.18 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 -179.082 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 11' ' ' LEU . 14.2 tp -63.98 -27.26 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.499 -178.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -55.34 -29.7 58.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.601 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -102.25 -40.43 6.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.96 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.611 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 85.4 mt -57.66 -36.11 71.44 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.805 -0.634 . . . . 10.0 112.498 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.48 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.72 0.295 . . . . 10.0 110.586 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.48 -31.22 70.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.383 0.611 . . . . 10.0 110.127 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.46 -18.18 61.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.397 -0.819 . . . . 10.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.57 -53.21 4.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.24 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.89 132.62 21.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 111.593 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.2 mt -88.97 114.46 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.211 -0.663 . . . . 10.0 109.211 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 69.5 tttt -116.38 100.47 53.48 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.401 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -89.41 32.9 0.36 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.121 2.548 . . . . 10.0 111.826 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -92.23 170.4 9.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.004 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -83.23 160.51 21.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.906 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.6 mm -108.98 153.78 10.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.441 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.032 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.6 OUTLIER -167.18 133.76 1.85 Allowed Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.88 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 44.3 Cg_exo -39.21 127.64 1.44 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.612 2.874 . . . . 10.0 113.031 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.89 127.5 24.59 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 123.349 2.699 . . . . 10.0 112.297 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.705 ' H ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -68.14 132.12 91.94 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.519 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.94 -20.58 45.38 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 123.445 2.763 . . . . 10.0 113.745 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -34.13 77.19 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.782 0.325 . . . . 10.0 111.244 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.557 HG22 ' HG ' ' A' ' 26' ' ' LEU . 24.1 m -128.37 -160.8 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.696 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' C' ' 50' ' ' HIS . 3.8 ptp180 -129.99 51.52 2.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 10.0 110.815 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -149.7 148.0 28.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.602 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' C' ' 84' ' ' GLU . 4.4 pp -72.01 154.27 41.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.909 0.385 . . . . 10.0 111.148 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.0 OUTLIER -92.03 162.42 14.38 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.756 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.2 tt0 -112.02 115.45 28.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.254 -0.276 . . . . 10.0 110.254 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.032 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.9 t70 -156.87 -76.33 0.09 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.865 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.18 -59.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.3 m0 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.359 -0.829 . . . . 10.0 109.857 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mmm . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.59 0.233 . . . . 10.0 111.506 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.63 142.14 28.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.568 HG11 HD13 ' B' ' 57' ' ' LEU . 95.6 t -127.8 125.66 65.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.775 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.75 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 55.5 m-85 -113.77 112.35 23.28 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.615 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.62 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -130.57 158.04 41.08 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.785 0.326 . . . . 10.0 111.06 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.449 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 31.7 mtm -126.24 112.81 16.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.734 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' B' ' 75' ' ' VAL . 46.1 mm -84.32 105.69 13.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -100.85 102.35 13.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 32.3 ttp85 -92.38 65.33 4.51 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.036 -1.468 . . . . 10.0 107.036 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 65.11 -86.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.022 -0.99 . . . . 10.0 111.479 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -95.24 -21.65 18.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.665 0.246 . . . . 10.0 111.665 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.6 m -99.58 105.18 17.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.665 0.269 . . . . 10.0 111.684 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 26.4 m -103.18 121.39 42.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.716 0.293 . . . . 10.0 110.236 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.67 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.3 mt -111.08 117.95 56.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.434 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -77.39 113.09 14.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.62 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -106.26 108.27 19.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.325 0.583 . . . . 10.0 111.928 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 1.053 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 2.6 t70 -95.46 106.45 18.52 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.684 -1.228 . . . . 10.0 107.684 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -129.28 -165.85 1.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.548 -0.296 . . . . 10.0 111.286 -178.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -125.32 160.65 28.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.28 -21.87 66.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.91 0.386 . . . . 10.0 111.953 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -16.98 57.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.903 -0.59 . . . . 10.0 111.389 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 7.6 m -72.99 147.0 45.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.887 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 38.9 p -96.79 166.13 11.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.922 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 55.8 t -66.58 -35.17 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.184 0.516 . . . . 10.0 109.705 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -60.58 -37.55 81.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.994 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -65.07 -34.63 78.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.958 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.682 HD11 HD21 ' B' ' 57' ' ' LEU . 89.1 mt -59.93 -45.37 92.83 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.806 -0.442 . . . . 10.0 109.806 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -64.28 -34.03 77.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.539 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -67.26 -33.29 75.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.148 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.407 HD12 ' HA ' ' B' ' 27' ' ' LEU . 64.8 mt -72.14 -46.29 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 88.0 t -64.2 -31.64 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.234 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.771 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.7 tt0 -56.36 -43.11 78.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.973 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.26 -19.71 79.45 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 10.0 112.515 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 75.2 mt -87.69 -59.75 2.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 111.845 0.313 . . . . 10.0 111.845 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 47.6 mt -80.83 -12.67 59.39 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.086 0.402 . . . . 10.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 84.9 mttt 60.17 36.35 21.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.155 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 37' ' ' ARG . 27.3 mtt180 -127.65 144.82 52.5 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.731 -179.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.52 127.68 16.49 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.699 2.933 . . . . 10.0 113.856 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.771 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 52.7 Cg_endo -71.39 -19.76 28.44 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.886 2.391 . . . . 10.0 111.81 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.66 -28.85 68.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.691 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -94.28 0.23 55.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.32 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -84.93 129.03 34.87 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.241 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.516 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 64.9 mmt-85 -116.7 107.11 14.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.189 -0.459 . . . . 10.0 109.862 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.4 mt -89.63 113.73 25.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.554 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . 0.404 ' CE2' ' HG3' ' B' ' 91' ' ' GLU . 54.9 m-85 -110.8 113.59 26.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.125 0.488 . . . . 10.0 111.813 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.485 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 37.6 tttm -119.01 128.91 54.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 62.93 37.78 11.71 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.488 0.493 . . . . 10.0 110.947 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 64.36 21.43 12.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.218 -0.901 . . . . 10.0 112.027 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -136.73 155.65 49.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.8 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.7 tp -78.13 141.13 38.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.466 -0.333 . . . . 10.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 mt -84.89 151.82 24.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.076 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.522 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 30.9 t0 -88.72 118.57 28.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.281 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.15 -26.99 68.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 10.0 112.267 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.37 2.69 81.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.074 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 51.1 mttp -109.81 154.97 22.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.231 0.539 . . . . 10.0 111.731 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.806 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 36.5 p -86.79 172.21 10.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.501 -0.772 . . . . 10.0 109.59 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.682 HD21 HD11 ' B' ' 27' ' ' LEU . 54.2 mt -63.71 -37.63 88.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.701 0.286 . . . . 10.0 110.399 179.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.83 -33.74 87.83 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.893 -0.67 . . . . 10.0 112.182 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.57 -25.82 45.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.697 0.284 . . . . 10.0 111.525 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 58.9 m -89.41 0.96 56.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.18 64.31 1.66 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.714 -0.755 . . . . 10.0 113.096 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.485 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 24.5 m-85 -124.7 47.37 2.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.857 0.36 . . . . 10.0 110.175 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 79.1 p -68.34 164.02 21.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -17.39 63.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.765 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.84 -30.17 50.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.09 0.471 . . . . 10.0 110.239 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.94 -36.27 12.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.075 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.75 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -108.45 100.22 9.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 109.875 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.41 ' HD3' ' OE1' ' B' ' 70' ' ' GLN . 0.3 OUTLIER -115.04 157.0 44.55 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.21 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.87 -14.79 46.26 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.372 2.048 . . . . 10.0 111.33 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.498 ' H ' ' HG3' ' B' ' 70' ' ' GLN . 0.0 OUTLIER -106.78 0.86 24.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.622 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.497 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -164.51 90.29 1.04 Allowed Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.126 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.449 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 6.3 Cg_exo -76.76 138.07 18.55 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.956 2.437 . . . . 10.0 111.449 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.96 122.88 16.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.666 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.03 122.6 25.16 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.569 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.445 ' HB ' HD13 ' B' ' 7' ' ' ILE . 45.3 t -125.6 129.24 72.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.37 140.85 19.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.848 -0.691 . . . . 10.0 111.785 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -119.86 105.46 11.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.049 0.452 . . . . 10.0 111.885 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.516 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.8 127.96 44.88 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -104.04 117.73 34.98 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.954 -0.298 . . . . 10.0 111.187 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -71.98 97.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.684 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -122.67 126.53 47.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.188 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.26 134.47 57.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.876 -0.602 . . . . 10.0 112.084 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 67.8 7.58 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.432 -0.804 . . . . 10.0 112.542 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 4.2 m -105.56 98.71 8.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.165 0.507 . . . . 10.0 110.325 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -66.92 -14.23 62.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.098 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -57.12 -32.17 66.07 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.998 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.48 67.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.79 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.7 mt -83.12 -5.25 59.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.521 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 27.2 m -105.28 -14.84 15.22 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.3 mt -104.23 6.29 10.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.155 0.502 . . . . 10.0 111.164 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.404 ' HG3' ' CE2' ' B' ' 45' ' ' TYR . 45.5 tt0 -104.52 107.24 57.36 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.173 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.618 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.5 Cg_exo -65.58 -10.66 27.22 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.049 2.5 . . . . 10.0 111.955 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -76.81 -20.68 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.912 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -119.14 -48.42 2.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.954 -0.567 . . . . 10.0 111.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.618 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 20.0 m -115.13 141.47 27.07 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.965 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.44 153.74 75.8 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.526 2.151 . . . . 10.0 111.929 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.19 141.46 94.44 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.046 2.497 . . . . 10.0 112.633 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -72.71 117.61 14.63 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.187 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 31.6 tp -146.32 124.23 6.18 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.486 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.415 ' HG2' ' HE1' ' C' ' 50' ' ' HIS . 22.7 Cg_exo -66.64 136.27 41.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.751 2.301 . . . . 10.0 112.13 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -66.83 -30.91 71.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.397 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 28.7 m -70.91 -16.04 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.496 0.665 . . . . 10.0 110.243 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.723 ' HA ' HE22 ' B' ' 106' ' ' GLN . 88.1 mmm -124.27 54.49 1.35 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.318 -0.856 . . . . 10.0 108.99 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.529 ' H ' ' CD ' ' B' ' 105' ' ' PRO . 39.9 tttm -132.23 -49.5 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.279 -0.873 . . . . 10.0 112.329 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.529 ' CD ' ' H ' ' B' ' 104' ' ' LYS . 10.3 Cg_exo -73.02 65.57 4.15 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 122.309 2.006 . . . . 10.0 111.958 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.723 HE22 ' HA ' ' B' ' 103' ' ' MET . 1.5 mt-30 -134.72 174.97 9.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.902 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -90.87 176.96 6.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.845 0.355 . . . . 10.0 111.201 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -102.93 135.62 44.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.123 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -88.82 -143.64 9.58 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.046 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.84 -38.47 11.22 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.185 0.516 . . . . 10.0 110.722 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.679 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.3 m -76.75 159.61 30.0 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.761 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . 0.497 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.16 121.14 14.98 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 179.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 72.33 16.92 4.97 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.915 0.759 . . . . 10.0 111.903 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.679 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 27.0 tt0 -71.53 119.98 16.45 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.822 0.344 . . . . 10.0 110.078 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.88 122.48 33.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.834 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.437 ' HB1' HE22 ' B' ' 118' ' ' GLN . . . -106.9 103.28 12.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.883 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.515 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.5 t -90.46 101.38 12.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.52 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.437 HE22 ' HB1' ' B' ' 116' ' ' ALA . 1.7 mp0 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.78 0.324 . . . . 10.0 111.363 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.481 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.2 ttpt -110.87 117.59 33.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.707 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.53 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 31.7 mt -92.61 123.56 36.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.081 -0.509 . . . . 10.0 109.839 179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 mt -107.57 116.98 52.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 3.8 p -89.04 177.76 6.56 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.494 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 13.7 m -76.99 2.85 13.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.862 0.363 . . . . 10.0 111.658 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -102.14 3.67 38.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.902 0.382 . . . . 10.0 110.356 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.56 12.83 84.13 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.649 -0.786 . . . . 10.0 111.398 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.6 133.94 33.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.657 0.265 . . . . 10.0 110.324 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.481 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 21.5 mt-10 -107.18 126.66 52.68 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.071 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.66 108.57 16.98 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.562 -0.29 . . . . 10.0 110.99 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.67 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 9.4 mm -89.79 118.68 35.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.841 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 23.6 t -105.95 135.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 1.053 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 53.7 tttt -59.71 132.04 52.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 110.135 -0.321 . . . . 10.0 110.135 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 11.2 tpt180 -52.06 -37.04 52.39 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.447 0.467 . . . . 10.0 111.21 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.502 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 58.0 tt0 -54.53 -43.22 71.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.537 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -85.27 -33.36 22.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.035 0.445 . . . . 10.0 110.742 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.47 91.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.521 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 89.2 mt -58.39 -48.18 81.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.966 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -39.54 93.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.468 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -64.88 -36.7 85.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.672 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.8 -6.7 82.48 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.657 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 19.8 m -91.02 -22.1 20.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.307 0.575 . . . . 10.0 109.71 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.5 mt -76.6 152.44 5.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.651 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -70.62 80.53 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.175 0.512 . . . . 10.0 110.529 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -97.36 178.15 5.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.678 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 94.3 mmm -78.5 35.39 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.981 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.57 -26.54 66.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.353 0.597 . . . . 10.0 109.606 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 4.3 m -95.54 17.65 14.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.243 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.85 -61.99 3.8 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.573 -0.739 . . . . 10.0 112.673 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.33 -174.8 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.514 2.143 . . . . 10.0 111.901 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.04 -79.21 0.15 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.986 -0.626 . . . . 10.0 112.519 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -122.24 127.71 50.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -88.65 85.17 6.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.317 0.579 . . . . 10.0 111.076 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.11 155.39 32.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.34 -25.43 49.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.996 0.739 . . . . 10.0 112.996 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.11 -39.45 90.02 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.616 -0.512 . . . . 10.0 109.616 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.532 ' O ' HG22 ' C' ' 42' ' ' VAL . 14.9 tp10 -88.84 -13.98 38.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.267 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 6.8 m -78.27 -40.26 37.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 10.0 110.191 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -75.66 -44.43 42.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.179 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -128.63 103.62 7.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.321 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.532 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.9 t -94.8 123.64 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.885 -178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -101.35 121.03 41.17 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.877 0.37 . . . . 10.0 110.892 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.562 ' HB3' HD12 ' C' ' 47' ' ' ILE . 95.3 m-85 -101.61 117.31 34.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.956 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 6.4 mmt180 -92.16 132.79 36.35 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.374 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 1.4 mp0 75.11 3.81 4.15 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.998 0.811 . . . . 10.0 112.279 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.562 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.1 mt -106.62 109.02 62.85 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.984 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.57 157.68 59.5 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 123.152 2.568 . . . . 10.0 112.127 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.9 p -64.78 -39.36 93.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.498 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . 0.426 ' HB2' ' HD3' ' A' ' 30' ' ' ARG . 6.7 m80 -52.24 -59.07 4.83 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.818 0.673 . . . . 10.0 112.818 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.467 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.7 m -64.93 -35.66 75.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 10.0 111.397 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.78 -33.97 77.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.804 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 26.1 m -61.92 -43.06 99.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.893 0.378 . . . . 10.0 110.547 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -66.43 -35.6 80.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.311 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' C' ' 51' ' ' VAL . 88.1 t -63.36 -47.55 91.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.09 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 36.0 m -60.29 -42.92 96.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.854 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 70.3 mtm -67.26 -37.27 83.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.611 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 84.4 t80 -65.74 -41.95 91.56 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.427 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.409 ' O ' HG23 ' C' ' 63' ' ' VAL . 6.8 m-85 -64.72 -45.7 85.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.104 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 42.9 m -58.69 -42.35 88.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.301 0.572 . . . . 10.0 109.665 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -64.75 -43.7 92.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.522 -0.763 . . . . 10.0 110.143 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -62.79 -40.75 98.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.098 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.409 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.2 t -60.07 -50.48 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.1 mmt180 -68.89 -37.85 79.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.338 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 69.0 t80 -58.2 -48.24 80.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.064 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.13 7.05 23.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.67 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -111.85 -46.93 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.177 -0.327 . . . . 10.0 111.57 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 6.3 m -146.15 -34.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.555 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 4.9 m -80.74 42.5 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.296 0.48 . . . . 10.0 112.296 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -88.06 -7.13 57.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.241 0.543 . . . . 10.0 110.066 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -78.76 -21.54 47.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.647 -0.706 . . . . 10.0 111.111 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.636 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 39.7 pt -95.96 163.8 20.17 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.194 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.636 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 80.8 Cg_endo -76.99 -177.31 3.72 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.304 2.003 . . . . 10.0 112.726 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.96 169.9 13.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.009 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -54.16 128.98 58.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.556 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -50.76 129.49 27.5 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.126 2.551 . . . . 10.0 112.834 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 pt -81.65 36.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.568 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -80.08 -59.71 0.53 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.395 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.568 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 72.1 Cg_endo -79.74 119.67 4.09 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.764 1.643 . . . . 10.0 110.505 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.35 12.32 1.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 38.4 mm -78.9 75.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.408 0.623 . . . . 10.0 109.952 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -138.92 -43.21 0.47 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.119 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.413 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 13.4 tp -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.644 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.591 ' HA ' HD23 ' A' ' 32' ' ' LEU . 23.9 mp0 -60.5 -37.29 80.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.325 -0.852 . . . . 10.0 109.47 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 8' ' ' LEU . 60.3 mt -79.49 -36.64 38.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.459 -0.791 . . . . 10.0 109.731 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.77 -31.75 73.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.525 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.9 ttp -58.98 -25.2 63.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.915 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.15 -35.49 73.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.05 -55.2 0.56 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.293 0.849 . . . . 10.0 113.293 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -81.97 36.17 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.117 0.484 . . . . 10.0 111.14 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.695 -0.669 . . . . 10.0 109.574 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.637 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 112.195 -0.362 . . . . 10.0 112.195 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.448 ' CB ' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -68.0 -57.82 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.214 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.828 HD21 ' HB3' ' C' ' 85' ' ' LEU . 23.5 tp -63.12 -27.85 69.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.933 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -55.51 -35.09 65.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.265 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -95.36 -37.33 11.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.329 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 8' ' ' LEU . 95.0 mt -63.07 -36.85 84.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.819 -0.628 . . . . 10.0 112.385 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.8 88.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.349 . . . . 10.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.3 tp -68.6 -30.03 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.279 0.561 . . . . 10.0 109.547 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.43 -8.89 59.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.52 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.15 -35.69 11.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.171 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.669 ' HA ' HG22 ' C' ' 77' ' ' ILE . 3.7 tp -163.56 122.38 2.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.172 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.0 mt -82.55 92.65 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.448 -0.945 . . . . 10.0 108.448 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 79.5 tttt -104.45 107.21 57.16 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.44 -178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -95.29 52.62 0.2 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.325 2.684 . . . . 10.0 111.173 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 69.1 mttt -108.87 174.82 5.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.874 -179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -80.47 143.02 33.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.739 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -100.24 103.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.074 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.094 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.3 OUTLIER -120.88 136.24 25.38 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.416 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.7 Cg_exo -34.5 133.49 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.147 3.231 . . . . 10.0 113.624 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.695 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 29.2 Cg_endo -62.98 138.23 66.78 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.0 2.467 . . . . 10.0 112.442 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -71.48 125.76 91.76 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.376 179.38 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -61.13 -22.33 74.35 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.224 2.616 . . . . 10.0 113.198 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.47 -35.89 82.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.051 0.453 . . . . 10.0 111.074 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 t -120.07 -132.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.86 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.0 ptp180 -158.98 52.66 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.112 0.482 . . . . 10.0 111.258 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 14.9 tttm -149.57 148.44 29.36 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.968 -0.753 . . . . 10.0 108.968 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.695 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.65 148.9 44.35 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.83 0.347 . . . . 10.0 110.681 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -91.4 172.93 8.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.075 -179.108 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.457 ' H ' HG22 ' A' ' 33' ' ' THR . 6.7 mt-10 -117.16 113.59 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.399 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.094 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.4 t70 -156.57 -81.64 0.07 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 -62.62 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.9 m0 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.567 -0.73 . . . . 10.0 109.54 179.654 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 mmm . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.949 0.404 . . . . 10.0 110.801 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.77 122.95 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.922 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.415 HG11 HD13 ' B' ' 57' ' ' LEU . 93.3 t -123.65 116.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.107 0.48 . . . . 10.0 111.095 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.47 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 44.7 m-85 -105.08 110.97 23.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.551 -0.75 . . . . 10.0 109.473 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.67 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -124.56 154.63 40.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.991 0.425 . . . . 10.0 111.646 -179.289 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.596 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 53.9 mtm -122.77 104.87 9.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.334 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.496 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.4 mm -78.2 107.25 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.912 -0.773 . . . . 10.0 108.912 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -109.95 104.4 13.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.866 0.691 . . . . 10.0 112.866 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.456 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 27.8 ttp85 -89.03 67.43 8.1 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.595 -1.261 . . . . 10.0 107.595 177.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.549 ' HB2' HG12 ' B' ' 90' ' ' ILE . 10.1 t-160 67.77 -76.69 0.05 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.174 -0.921 . . . . 10.0 111.485 -178.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.407 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 72.3 mmtt -110.01 -9.35 14.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.483 -0.326 . . . . 10.0 111.382 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.8 m -105.2 99.59 9.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.062 -179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.2 m -101.17 125.53 47.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.923 0.392 . . . . 10.0 111.019 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 40.2 mt -121.52 121.85 65.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.313 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . 0.47 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 62.3 t80 -79.6 121.69 25.58 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.999 -0.371 . . . . 10.0 109.999 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.67 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.0 m -114.7 119.82 38.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.089 0.471 . . . . 10.0 111.452 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.678 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.9 t70 -103.31 103.68 13.72 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.207 -1.034 . . . . 10.0 108.207 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . 0.466 ' O ' ' HD3' ' B' ' 19' ' ' LYS . . . -130.64 -166.66 1.72 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.653 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.466 ' HD3' ' O ' ' B' ' 18' ' ' ALA . 20.7 mmtt -128.88 165.5 20.92 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.754 -0.462 . . . . 10.0 109.754 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.401 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 16.9 mp0 -61.52 -28.46 69.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.649 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 m -69.13 -21.49 64.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.85 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 2.3 m -73.75 145.23 45.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.743 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 31.5 p -94.34 162.97 13.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.761 0.315 . . . . 10.0 111.033 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.517 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 97.4 t -64.89 -34.03 67.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.133 0.492 . . . . 10.0 109.992 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -62.56 -34.99 78.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.406 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -68.24 -33.37 74.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.906 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.77 HD11 HD21 ' B' ' 57' ' ' LEU . 87.1 mt -62.15 -43.71 98.24 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.735 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.1 mttt -62.23 -33.81 75.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.237 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtp180 -66.2 -40.44 90.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.512 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.61 -46.8 91.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.835 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.98 -36.84 77.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.673 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.628 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.4 tm-20 -56.5 -43.39 79.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.34 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.88 -18.02 78.74 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -94.08 -57.29 4.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.774 0.321 . . . . 10.0 111.528 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.588 HD21 HG21 ' B' ' 12' ' ' THR . 22.1 mt -76.87 -14.19 59.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 83.3 mttt 64.75 31.61 11.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.373 0.606 . . . . 10.0 110.994 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.402 ' HA ' ' HD3' ' B' ' 38' ' ' PRO . 62.8 mtt-85 -123.42 135.08 25.67 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.856 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 74.7 Cg_exo -53.07 138.82 62.61 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 123.384 2.723 . . . . 10.0 113.028 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.735 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 13.9 Cg_exo -70.82 -12.53 31.03 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.831 2.354 . . . . 10.0 111.19 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.15 -45.66 75.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.204 -0.907 . . . . 10.0 112.134 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -99.83 16.76 22.68 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -88.04 123.45 32.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.816 0.341 . . . . 10.0 110.849 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' B' ' 43' ' ' ARG . 39.7 mmt-85 -116.1 111.86 20.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.11 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 68.2 mt -96.01 120.39 36.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.402 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -113.75 127.8 56.16 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.496 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 34.0 tttm -135.49 137.26 41.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 48' ' ' ASP . 4.7 m-20 62.44 25.26 15.06 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.347 0.405 . . . . 10.0 110.379 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 47' ' ' ASP . 78.6 m-20 75.18 4.32 4.16 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.404 -0.816 . . . . 10.0 112.239 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -119.54 163.11 17.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.069 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.0 tp -79.97 141.14 36.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.544 0.211 . . . . 10.0 110.689 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -80.37 155.58 27.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.318 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -98.92 115.37 28.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.859 0.361 . . . . 10.0 111.199 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.517 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 78.4 m-20 -60.33 -29.37 68.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.639 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 3.84 75.88 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.003 -0.617 . . . . 10.0 113.485 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -118.02 163.53 16.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.066 0.46 . . . . 10.0 111.017 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.778 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 41.5 p -92.25 170.44 9.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.896 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.77 HD21 HD11 ' B' ' 27' ' ' LEU . 34.7 mt -62.26 -41.91 98.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.904 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.73 -40.58 95.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.09 -0.576 . . . . 10.0 112.512 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -72.27 -21.16 61.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 10.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 70.2 m -89.47 3.17 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.009 0.433 . . . . 10.0 111.646 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.61 2.72 63.1 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.724 -0.751 . . . . 10.0 113.293 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.496 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 57.5 m-85 -75.77 96.85 3.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.05 0.425 . . . . 10.0 110.171 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 55.1 p -114.94 164.55 13.98 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 20.0 m -72.52 -2.45 19.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.304 0.573 . . . . 10.0 110.476 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -90.17 -49.42 6.57 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.642 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -35.02 55.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.043 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.11 103.69 12.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.526 ' HB3' ' HG3' ' B' ' 70' ' ' GLN . 16.3 mtm180 -119.31 163.07 28.81 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.731 -178.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.409 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 32.8 Cg_endo -66.78 -14.88 45.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.043 1.829 . . . . 10.0 110.531 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.526 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -103.76 -1.62 27.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.169 -0.923 . . . . 10.0 110.104 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.729 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -163.63 84.17 1.35 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.438 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.9 Cg_exo -76.87 136.41 16.68 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.855 2.37 . . . . 10.0 111.837 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 122.19 17.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.418 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -80.81 124.69 29.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.948 0.404 . . . . 10.0 111.448 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.496 ' HB ' HD13 ' B' ' 7' ' ' ILE . 39.6 t -117.87 125.92 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.217 -0.66 . . . . 10.0 109.217 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -80.95 126.85 7.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.768 -0.73 . . . . 10.0 111.91 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.54 111.17 22.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.719 0.295 . . . . 10.0 111.084 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -107.29 128.91 54.87 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.669 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -105.04 116.58 32.19 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.229 -0.285 . . . . 10.0 110.229 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -76.75 85.5 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.581 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -96.72 131.42 43.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.77 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.79 140.22 58.85 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.417 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.28 7.4 4.87 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.618 -0.719 . . . . 10.0 111.982 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.8 m -117.87 104.59 11.08 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -76.68 0.36 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 10.0 112.061 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.1 tt0 -57.12 -32.22 66.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.04 0.448 . . . . 10.0 110.657 179.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.23 -26.24 67.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.747 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.8 mt -75.66 -26.29 57.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.831 0.348 . . . . 10.0 111.005 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 22.4 m -83.61 -32.32 25.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.006 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' B' ' 10' ' ' HIS . 17.6 mt -81.78 -27.09 9.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.388 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -70.01 110.51 6.8 Favored Pre-proline 0 C--O 1.234 0.284 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.314 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.617 ' HA ' ' O ' ' B' ' 95' ' ' SER . 15.4 Cg_exo -69.88 -8.89 24.74 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.544 2.829 . . . . 10.0 112.531 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.842 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.9 m -99.0 -44.68 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.236 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.617 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 13.0 m -107.48 144.35 29.05 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.067 -179.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 159.84 47.42 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.595 2.197 . . . . 10.0 111.576 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.22 128.07 21.79 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.559 2.172 . . . . 10.0 111.473 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.76 106.84 3.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.101 0.476 . . . . 10.0 111.668 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 35.1 tp -129.78 120.71 19.65 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.188 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -51.43 120.31 6.73 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.755 2.303 . . . . 10.0 111.761 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.01 -33.7 71.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.427 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.14 -15.32 18.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.808 0.337 . . . . 10.0 111.347 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 67.5 mmm -115.22 21.28 14.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.412 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.447 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 50.3 tttm -96.41 -51.08 0.23 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 113.565 0.95 . . . . 10.0 113.565 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.447 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 56.5 Cg_endo -71.62 82.87 1.12 Allowed 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.145 1.897 . . . . 10.0 112.743 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -161.03 -171.69 3.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.689 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.49 ' HB2' HE22 ' B' ' 118' ' ' GLN . 5.5 t0 -104.83 174.99 5.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.916 0.389 . . . . 10.0 111.215 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -100.99 157.12 16.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.49 -129.99 5.1 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.678 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 10.5 m -110.93 -31.09 7.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.093 0.473 . . . . 10.0 110.024 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.729 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 51.0 m -86.53 170.76 11.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.736 -0.665 . . . . 10.0 110.932 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.47 134.04 36.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.1 t30 70.59 7.38 6.19 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.555 0.535 . . . . 10.0 111.032 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 50.7 tt0 -84.9 121.06 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.644 -0.502 . . . . 10.0 109.644 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -108.87 151.78 25.8 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.741 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -128.81 103.81 7.27 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.477 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.586 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.1 t -67.7 134.29 30.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' B' ' 107' ' ' ASP . 12.6 mp0 . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.183 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.5 t . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.061 0.457 . . . . 10.0 110.841 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -105.25 115.86 30.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.452 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.474 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 25.2 mt -90.63 133.29 35.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.882 -0.784 . . . . 10.0 108.882 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 13.3 mt -118.6 113.63 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.762 -0.199 . . . . 10.0 110.691 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.15 161.33 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -20.98 64.78 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.256 0.465 . . . . 10.0 112.256 -179.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -74.15 -10.48 59.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.704 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.16 39.25 8.02 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.763 -0.732 . . . . 10.0 111.595 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -111.73 140.95 45.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.719 0.295 . . . . 10.0 110.265 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.611 ' HB2' ' HA ' ' B' ' 12' ' ' THR . 26.3 mt-10 -99.86 128.64 45.94 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.495 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 65.6 m-85 -127.69 96.73 4.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.95 0.405 . . . . 10.0 110.531 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 5.2 mp -93.55 116.48 34.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.001 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.5 t -100.54 141.5 17.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.823 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.678 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 75.3 tttt -55.98 130.09 42.44 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.169 0.293 . . . . 10.0 110.237 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.649 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 63.4 ttt180 -54.6 -34.8 62.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.702 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -56.49 -46.85 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.154 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -74.65 -31.95 62.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.282 0.563 . . . . 10.0 110.15 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.44 68.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.909 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 55.4 mt -58.75 -56.82 17.3 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.151 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -65.9 -31.39 72.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.716 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 43.9 m -65.32 -33.27 75.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 10.0 109.922 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.17 -12.82 82.8 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.128 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.09 -12.5 57.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.389 0.614 . . . . 10.0 110.029 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 45.5 mt -90.71 146.69 5.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.813 -0.81 . . . . 10.0 108.813 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.33 76.52 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.438 0.637 . . . . 10.0 111.102 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' SER . . . -85.55 -174.21 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.094 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.637 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 91.7 mmm -79.12 37.36 0.31 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mp -69.8 -32.64 71.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.16 13.96 19.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.17 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . 0.428 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -75.97 -56.3 4.5 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.633 -0.712 . . . . 10.0 113.109 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 42.0 Cg_endo -66.73 179.63 2.09 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.661 2.241 . . . . 10.0 112.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.28 -46.77 14.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.85 -0.69 . . . . 10.0 112.698 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -141.76 104.68 4.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.766 0.317 . . . . 10.0 110.606 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -87.02 89.61 8.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.98 0.419 . . . . 10.0 110.602 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.98 174.91 8.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.569 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -64.23 -25.85 68.25 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.673 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -58.98 -43.28 91.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.054 0.454 . . . . 10.0 109.779 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.561 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.7 mp0 -75.34 -18.49 59.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.822 179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.9 m -78.57 -30.32 46.75 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -81.68 -50.88 8.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.625 -0.716 . . . . 10.0 109.661 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -128.18 107.13 9.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.412 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.561 HG22 ' O ' ' C' ' 38' ' ' GLU . 1.8 t -94.55 103.77 15.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.455 -179.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -89.39 122.68 32.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.036 0.446 . . . . 10.0 111.053 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.702 ' HB3' HD12 ' C' ' 47' ' ' ILE . 86.5 m-85 -103.62 144.03 31.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.632 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 -113.65 132.52 55.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.507 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 61.02 28.94 18.68 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.694 0.621 . . . . 10.0 112.663 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.702 HD12 ' HB3' ' C' ' 44' ' ' PHE . 83.7 mt -121.82 103.08 40.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.587 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.447 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 48.7 Cg_exo -57.5 140.28 92.77 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.092 2.528 . . . . 10.0 113.097 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -59.61 -36.1 75.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.278 -0.873 . . . . 10.0 111.093 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -51.22 70.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.43 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 17.1 m -70.85 -29.21 36.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.95 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 tp -66.37 -36.91 84.08 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.831 -0.433 . . . . 10.0 109.831 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -61.98 -33.94 75.24 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.139 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 13.4 tptp -65.42 -39.93 92.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.571 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -67.24 -46.52 83.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.933 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 76.5 m -58.21 -42.87 87.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.428 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.2 mtm -64.9 -39.52 93.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.815 0.34 . . . . 10.0 110.884 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -67.48 -39.06 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.379 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -64.22 -46.5 83.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.06 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 31.5 m -59.19 -42.1 90.06 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.374 0.607 . . . . 10.0 109.782 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.409 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 14.5 t80 -66.56 -43.48 84.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.39 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -63.62 -38.77 92.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.492 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.35 -47.44 92.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.986 0.422 . . . . 10.0 110.253 179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.867 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 16.3 t80 -58.21 -45.08 88.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.639 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -87.31 21.54 2.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.202 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -131.4 -47.82 0.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.085 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.22 -39.87 0.4 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.011 0.375 . . . . 10.0 112.011 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.57 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 0.9 OUTLIER -76.53 39.67 0.21 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.752 0.649 . . . . 10.0 112.752 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.04 -11.03 45.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.126 0.488 . . . . 10.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -92.57 4.82 52.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.42 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 49.2 pt -118.25 156.38 50.76 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.186 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.69 159.72 16.43 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.2 2.6 . . . . 10.0 112.999 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 13.4 tp10 -69.09 171.08 8.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.215 -0.902 . . . . 10.0 109.597 179.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.411 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 36.4 t80 -47.91 130.76 11.76 Favored Pre-proline 0 C--O 1.233 0.19 0 O-C-N 123.291 0.369 . . . . 10.0 110.923 179.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -53.09 111.8 0.76 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 123.078 2.519 . . . . 10.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.669 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.1 pt -76.75 61.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.371 0.605 . . . . 10.0 111.18 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -114.67 -53.3 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.587 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 24.8 Cg_exo -64.11 119.72 6.85 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.948 1.765 . . . . 10.0 111.486 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.78 -14.58 46.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.404 0.52 . . . . 10.0 112.404 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.3 mm -79.62 98.67 3.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.046 0.451 . . . . 10.0 110.471 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -168.08 -43.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.341 -0.845 . . . . 10.0 109.648 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.466 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.9 tp -67.18 -24.28 65.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.551 ' HA ' HD23 ' A' ' 32' ' ' LEU . 32.9 mp0 -62.88 -29.65 70.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.985 -1.007 . . . . 10.0 109.779 178.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.828 ' HB3' HD21 ' A' ' 8' ' ' LEU . 50.1 mt -77.01 -32.45 57.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.577 -0.738 . . . . 10.0 109.452 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -21.41 63.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.984 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 34.0 ttp -66.1 -18.74 65.54 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.514 -0.766 . . . . 10.0 110.663 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.95 -33.18 75.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.776 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.72 -61.28 0.37 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.985 0.803 . . . . 10.0 112.933 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -82.65 45.95 1.03 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.903 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.598 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 0.7 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.097 -0.705 . . . . 10.0 109.097 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 112.145 -0.382 . . . . 10.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.443 ' OG ' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -64.23 -55.9 18.39 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.906 0.706 . . . . 10.0 112.906 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' C' ' 85' ' ' LEU . 18.1 tp -60.37 -30.47 69.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -178.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.69 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 31.1 mt-30 -58.12 -32.68 68.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 10.0 111.042 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -96.95 -40.8 8.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.001 0.429 . . . . 10.0 110.426 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.519 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 83.9 mt -60.27 -42.7 95.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.034 -0.53 . . . . 10.0 112.16 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.23 64.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.727 0.298 . . . . 10.0 111.082 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.2 tp -63.83 -40.06 95.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.023 0.44 . . . . 10.0 110.422 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -14.15 59.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.955 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.9 -24.16 20.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.776 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 2.7 tp -164.54 110.37 1.0 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 10.0 111.835 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.2 mt -84.31 88.02 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.625 ' HB3' HD22 ' C' ' 83' ' ' LEU . 83.7 tttt -96.1 106.65 29.83 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.836 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 3.4 Cg_endo -88.23 60.32 3.02 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 123.546 2.831 . . . . 10.0 112.092 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -126.91 167.28 16.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -79.32 151.97 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.24 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.631 HD11 HD23 ' C' ' 83' ' ' LEU . 48.2 mm -113.47 100.02 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.906 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 36.6 tttp -107.63 138.26 19.94 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -34.41 133.12 0.16 Allowed 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.756 2.97 . . . . 10.0 113.422 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.916 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.0 Cg_endo -53.42 151.85 22.26 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.898 3.065 . . . . 10.0 114.281 -178.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mp -81.07 122.36 81.59 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.641 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -59.19 -26.21 80.91 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.274 2.649 . . . . 10.0 113.091 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -35.96 78.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.62 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.431 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 4.3 m -118.59 -145.53 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.763 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 2.5 ptp180 -143.29 53.8 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.381 0.61 . . . . 10.0 110.634 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.405 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.6 tttm -150.38 150.28 31.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.026 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.916 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.1 pp -76.04 156.12 34.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 10.0 110.806 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.58 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -90.05 152.11 21.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.668 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -107.35 106.16 16.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.861 0.362 . . . . 10.0 110.509 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.906 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 t70 -164.36 -72.58 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.114 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.28 -69.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.143 -0.932 . . . . 10.0 109.4 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.855 0.359 . . . . 10.0 110.508 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.12 136.15 39.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.824 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.41 HG11 HD13 ' B' ' 57' ' ' LEU . 52.6 t -124.97 124.46 67.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.165 0.507 . . . . 10.0 110.93 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.46 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.9 m-85 -113.74 111.7 22.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.735 179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.738 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -126.32 156.15 40.88 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.962 0.411 . . . . 10.0 111.66 -179.779 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.651 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 67.3 mtm -124.2 107.77 11.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.313 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.55 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -80.56 109.45 15.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -105.74 105.89 16.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.162 0.431 . . . . 10.0 112.162 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.513 ' HB2' HD23 ' B' ' 77' ' ' LEU . 10.0 ttp85 -104.6 95.42 5.9 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.823 -1.177 . . . . 10.0 107.823 177.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 66.13 -88.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.622 0.577 . . . . 10.0 109.691 -178.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -129.16 11.4 5.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.321 0.581 . . . . 10.0 110.434 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 4.2 m -106.45 99.08 8.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.293 178.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' B' ' 7' ' ' ILE . 30.9 m -100.68 126.29 47.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.903 0.382 . . . . 10.0 111.083 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.626 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 64.7 mt -114.66 119.64 62.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.581 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -76.91 117.42 18.5 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.311 -0.625 . . . . 10.0 109.311 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.738 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.5 m -112.23 109.82 19.72 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.815 0.672 . . . . 10.0 112.815 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.589 ' HB3' ' CD ' ' C' ' 14' ' ' LYS . 3.7 t70 -97.05 106.87 19.29 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.322 -1.362 . . . . 10.0 107.322 177.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.31 -168.86 2.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.905 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -124.89 161.02 27.48 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' B' ' 56' ' ' THR . 49.6 mt-10 -59.67 -27.1 66.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 10.0 111.74 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.56 -17.79 63.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.695 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 12.9 m -78.39 134.7 37.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.878 0.371 . . . . 10.0 110.781 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.1 p -85.13 167.26 15.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.197 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.85 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 93.3 t -63.39 -35.82 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 10.0 110.761 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 55.8 t80 -65.33 -33.34 75.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.638 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -65.74 -30.03 70.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.83 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.948 HD11 HD21 ' B' ' 57' ' ' LEU . 64.0 mt -66.8 -42.78 85.39 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.942 -0.762 . . . . 10.0 108.942 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.804 ' HB3' ' HB3' ' B' ' 39' ' ' PRO . 99.8 mttt -62.23 -31.57 72.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.212 -0.904 . . . . 10.0 110.526 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -64.59 -41.3 96.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.769 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -65.69 -43.4 93.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.96 -35.52 73.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.154 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.545 ' HB2' ' HG3' ' B' ' 39' ' ' PRO . 24.4 tt0 -60.97 -41.11 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.02 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.93 -20.88 79.71 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.04 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.9 mt -93.77 -49.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 23.8 mt -84.58 -14.84 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.334 0.494 . . . . 10.0 112.334 -178.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 63.74 32.02 13.92 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.12 0.486 . . . . 10.0 111.696 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -126.35 146.27 55.72 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.866 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.527 ' HA ' ' HD3' ' B' ' 39' ' ' PRO . 51.0 Cg_exo -56.71 133.01 55.28 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.418 2.745 . . . . 10.0 113.554 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.804 ' HB3' ' HB3' ' B' ' 28' ' ' LYS . 17.2 Cg_exo -70.3 -17.35 35.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.539 2.826 . . . . 10.0 112.165 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -65.51 -31.57 72.71 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.572 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.478 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 31.8 mm-40 -90.94 -1.72 57.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.644 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -89.28 126.34 35.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.37 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.511 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 21.9 mmt180 -116.41 113.63 23.13 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 48.4 mt -92.31 114.76 27.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.859 0.361 . . . . 10.0 111.18 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -110.65 115.75 30.13 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.795 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.613 ' HB3' HD21 ' B' ' 51' ' ' LEU . 13.4 tmtt? -129.09 135.96 49.6 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.259 -1.015 . . . . 10.0 108.259 179.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 65.61 32.67 9.06 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.48 0.488 . . . . 10.0 110.627 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.73 13.9 9.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.234 -0.894 . . . . 10.0 112.523 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -135.01 165.9 24.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.729 0.299 . . . . 10.0 110.73 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 tp -82.58 140.43 33.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.443 -0.344 . . . . 10.0 110.583 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.613 HD21 ' HB3' ' B' ' 46' ' ' LYS . 94.3 mt -87.87 146.25 25.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -88.43 113.76 24.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.64 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.85 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 90.4 m-20 -56.96 -29.68 63.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.125 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -76.49 -6.2 83.8 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.949 -0.643 . . . . 10.0 113.592 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -108.77 161.47 15.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.006 0.403 . . . . 10.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.761 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.8 p -87.4 169.4 12.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.5 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.948 HD21 HD11 ' B' ' 27' ' ' LEU . 51.5 mt -60.4 -43.5 96.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.189 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -55.27 -45.32 83.33 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.132 -0.556 . . . . 10.0 112.741 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -66.08 -28.93 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.111 0.412 . . . . 10.0 112.111 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . 0.442 ' HB3' HD22 ' B' ' 51' ' ' LEU . 56.4 m -83.79 11.14 7.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 10.0 112.101 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.87 49.12 7.27 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.763 -0.732 . . . . 10.0 112.777 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 36.6 m-85 -118.48 57.18 0.86 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.169 0.509 . . . . 10.0 110.317 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 14.3 p -76.71 161.6 28.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 10.0 110.728 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.2 p -64.55 -20.04 65.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.489 . . . . 10.0 111.952 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -78.32 -26.98 47.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.778 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -46.04 9.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.065 0.46 . . . . 10.0 109.869 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.46 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -104.1 105.49 15.68 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.54 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.458 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 68.1 mtt180 -116.39 161.13 33.15 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.222 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.584 ' HB3' ' HG3' ' C' ' 64' ' ' ARG . 27.5 Cg_endo -64.58 -19.07 64.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.219 1.946 . . . . 10.0 110.602 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.57 6.35 34.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.023 -0.989 . . . . 10.0 110.471 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.533 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -167.52 85.6 0.78 Allowed Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.925 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.651 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 3.7 Cg_exo -77.93 147.63 24.29 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.916 2.411 . . . . 10.0 111.669 179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.76 117.79 22.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.09 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.78 130.39 39.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.031 0.443 . . . . 10.0 111.622 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.55 ' HB ' HD13 ' B' ' 7' ' ' ILE . 43.9 t -124.36 132.41 71.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.05 129.37 9.03 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.846 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.513 HD23 ' HB2' ' B' ' 9' ' ' ARG . 39.3 tp -110.35 102.14 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.981 0.42 . . . . 10.0 111.962 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.511 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -93.12 132.61 37.1 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.372 -0.973 . . . . 10.0 108.372 178.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.478 ' CE1' ' HB2' ' B' ' 41' ' ' GLU . 52.1 t80 -117.07 119.1 34.22 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.848 -0.341 . . . . 10.0 111.398 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -70.76 117.52 12.38 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.997 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -131.23 149.96 52.35 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.395 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -76.58 126.13 30.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.665 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 73.87 -35.95 0.32 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.77 0.669 . . . . 10.0 112.567 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 0.2 OUTLIER -74.8 94.63 2.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.869 0.366 . . . . 10.0 110.199 179.185 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -79.24 16.45 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.909 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.47 ' O ' HG13 ' B' ' 90' ' ' ILE . 34.5 tt0 -61.33 -25.81 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.696 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.48 67.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.699 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.37 -41.62 98.77 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -79.19 -7.85 58.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.47 HG13 ' O ' ' B' ' 86' ' ' GLU . 8.0 mt -106.25 -0.52 9.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.481 0.658 . . . . 10.0 110.035 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.84 106.71 45.59 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.599 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.4 Cg_exo -65.83 -12.27 34.52 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.164 2.576 . . . . 10.0 112.146 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -76.6 -25.17 53.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.619 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.1 p -116.48 -32.77 5.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.432 -0.349 . . . . 10.0 111.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.599 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.0 m -125.03 146.97 55.36 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.483 0.183 . . . . 10.0 110.971 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.07 153.57 57.45 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 122.413 2.075 . . . . 10.0 111.539 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.61 133.67 40.69 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.715 2.276 . . . . 10.0 112.466 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.62 123.8 24.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.436 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.481 HD12 ' HD2' ' B' ' 100' ' ' PRO . 22.9 tp -147.25 128.76 7.31 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.408 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.481 ' HD2' HD12 ' B' ' 99' ' ' LEU . 10.9 Cg_endo -55.64 124.14 15.56 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.702 2.268 . . . . 10.0 111.564 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.86 -28.68 69.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.29 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.0 m -68.96 -12.49 16.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.147 0.499 . . . . 10.0 110.811 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.467 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 81.4 mmm -120.89 22.34 11.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.773 -0.648 . . . . 10.0 109.734 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -91.48 -51.18 0.31 Allowed Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 113.089 0.774 . . . . 10.0 113.089 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.5 68.41 6.16 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.349 2.032 . . . . 10.0 112.244 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.467 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 61.4 mt-30 -132.48 -177.71 4.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.37 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' B' ' 118' ' ' GLN . 2.4 t0 -96.81 169.46 9.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.515 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 135.02 37.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.74 -147.67 7.94 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.972 -0.632 . . . . 10.0 113.372 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -99.27 -26.88 14.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.934 0.397 . . . . 10.0 110.89 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.437 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 21.0 m -91.41 163.92 14.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.269 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . 0.533 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -67.45 125.36 25.88 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.676 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.3 t30 70.0 16.01 7.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.963 -0.562 . . . . 10.0 111.508 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 3.1 tt0 -81.3 135.35 35.7 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.98 138.4 52.2 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.235 -0.438 . . . . 10.0 111.098 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.53 ' HA ' HD11 ' C' ' 81' ' ' ILE . . . -116.54 116.31 27.38 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.616 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.557 ' H ' HD11 ' C' ' 81' ' ' ILE . 1.7 t -77.86 143.45 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.151 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.473 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 24.8 mp0 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.731 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 t . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.983 0.421 . . . . 10.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.706 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 37.0 ttpt -115.12 128.37 56.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.132 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.665 ' HB3' ' HE2' ' C' ' 44' ' ' PHE . 34.2 mt -96.37 125.11 40.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.842 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -102.02 117.41 47.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.637 0.256 . . . . 10.0 110.597 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -86.86 161.33 18.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.837 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.47 -24.67 67.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.019 -0.537 . . . . 10.0 112.316 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.31 8.66 8.6 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.694 0.283 . . . . 10.0 111.176 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 75.05 43.82 25.47 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 110.774 -0.93 . . . . 10.0 110.774 -179.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . 0.415 ' HE1' ' OG1' ' B' ' 13' ' ' THR . 11.5 t-80 -113.53 141.48 47.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.264 . . . . 10.0 110.451 -179.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.706 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 37.2 mt-10 -112.27 131.43 55.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.236 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.44 ' O ' ' HA ' ' C' ' 2' ' ' LYS . 38.5 m-85 -124.1 104.73 9.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.652 179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.626 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 8.9 mm -87.16 115.08 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -101.13 129.39 52.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 110.092 -0.336 . . . . 10.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.589 ' CD ' ' HB3' ' B' ' 17' ' ' ASP . 77.3 tttt -59.47 128.33 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.613 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 44.6 ttt180 -50.74 -35.96 34.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.47 0.545 . . . . 10.0 112.47 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -50.45 -46.67 56.78 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.333 0.396 . . . . 10.0 111.735 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -85.83 -27.71 24.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.164 0.507 . . . . 10.0 110.717 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . 0.426 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -66.41 -29.26 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 96.0 mt -63.5 -49.04 75.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 10.0 110.215 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.596 ' HB ' HG22 ' C' ' 63' ' ' VAL . 0.2 OUTLIER -66.18 -40.22 90.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.622 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 18.9 m -63.5 -35.34 80.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.081 0.467 . . . . 10.0 110.459 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.64 -5.0 85.87 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.068 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 10.1 m -89.22 -27.23 20.76 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.359 0.6 . . . . 10.0 109.81 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 12.6 mt -75.65 153.3 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.678 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.11 85.34 1.03 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.089 0.471 . . . . 10.0 110.433 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.443 ' HA ' ' OG ' ' A' ' 7' ' ' SER . . . -97.32 177.45 5.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.066 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 90.9 mmm -80.71 35.31 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.151 0.426 . . . . 10.0 112.151 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mp -69.06 -28.74 66.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.246 0.546 . . . . 10.0 109.9 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.37 14.33 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.05 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . 0.424 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -74.78 -58.99 3.88 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.749 -0.66 . . . . 10.0 112.84 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 29.0 Cg_endo -62.95 166.16 14.84 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.556 2.17 . . . . 10.0 112.246 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -49.1 79.0 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.863 -0.608 . . . . 10.0 112.831 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -147.57 115.04 6.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.698 0.285 . . . . 10.0 110.564 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -85.03 91.46 8.09 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.867 -0.419 . . . . 10.0 109.867 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.6 166.69 23.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.575 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.13 -32.12 73.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.619 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -63.94 -38.28 90.49 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.563 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.1 tp10 -72.24 -24.32 61.36 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.91 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -74.96 -30.38 61.19 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -84.32 -52.96 5.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.26 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.535 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 50.5 mt-10 -124.94 100.36 6.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.824 -0.626 . . . . 10.0 109.904 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.563 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -85.01 114.93 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.048 -0.523 . . . . 10.0 109.986 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -93.17 114.74 27.31 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.96 0.41 . . . . 10.0 111.117 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.665 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 71.9 m-85 -93.68 151.93 19.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.881 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -125.05 130.44 52.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.829 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 69.74 8.54 6.77 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.815 -0.63 . . . . 10.0 112.083 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.469 ' HA ' ' HD3' ' C' ' 48' ' ' PRO . 61.4 mt -105.44 114.58 63.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.692 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 11.8 Cg_exo -73.06 142.78 34.99 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.931 2.421 . . . . 10.0 111.708 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 1.7 p -60.9 -33.37 73.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.66 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -51.9 65.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.936 -0.574 . . . . 10.0 111.667 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.58 ' HB ' HD21 ' C' ' 85' ' ' LEU . 26.7 m -78.67 -27.65 14.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.721 0.296 . . . . 10.0 111.268 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 40.3 tp -65.79 -32.88 74.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.074 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 84.5 p -61.28 -39.3 89.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.637 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -65.93 -32.83 74.55 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.655 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.07 -47.64 84.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 10.9 m -62.93 -40.07 96.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.797 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 54.8 ttm -63.26 -45.74 90.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.252 -0.885 . . . . 10.0 110.431 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.519 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 89.4 t80 -63.52 -41.76 98.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.45 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.1 m-85 -61.88 -45.07 95.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.379 179.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 51.4 m -59.98 -42.12 93.49 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.304 0.574 . . . . 10.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.51 -41.63 96.3 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.404 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 tptt -63.11 -39.27 94.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.18 -0.464 . . . . 10.0 111.042 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.596 HG22 ' HB ' ' C' ' 20' ' ' THR . 71.1 t -59.2 -48.42 86.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.126 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.584 ' HG3' ' HB3' ' B' ' 69' ' ' PRO . 13.4 mmt180 -70.7 -41.01 72.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.157 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.694 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 78.4 t80 -57.61 -43.74 84.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.257 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 24.99 2.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.144 0.497 . . . . 10.0 111.267 -179.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -135.53 -58.52 0.78 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.627 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.39 -28.8 2.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.322 0.49 . . . . 10.0 112.322 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.694 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.2 m -86.93 32.93 0.66 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.37 5.48 20.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 10.0 111.048 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -103.69 -3.38 25.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.963 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.765 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.0 pt -111.36 167.23 9.37 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.118 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.765 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 60.1 Cg_endo -72.74 170.86 18.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.39 2.06 . . . . 10.0 113.08 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.7 tp10 -70.01 168.15 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.565 -0.743 . . . . 10.0 109.609 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.466 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 38.4 t80 -51.64 134.61 35.39 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 123.202 0.314 . . . . 10.0 110.647 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -50.7 121.52 8.12 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.067 2.511 . . . . 10.0 112.718 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . . . . . . . . . 26.6 pt -84.25 44.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.799 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.599 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -101.64 -53.94 0.14 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 112.768 0.655 . . . . 10.0 112.768 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 21.4 Cg_exo -66.96 112.71 2.56 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.087 1.858 . . . . 10.0 112.598 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.487 ' HA ' HD21 ' A' ' 16' ' ' LEU . 45.1 mt-10 -75.07 55.48 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.335 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . 0.557 HD11 ' H ' ' B' ' 117' ' ' VAL . 13.2 mm -120.36 -11.7 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 121.159 0.504 . . . . 10.0 111.253 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.776 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.11 -40.36 82.57 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.631 HD23 HD11 ' A' ' 22' ' ' ILE . 6.5 tp -67.44 -30.73 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 10.0 110.282 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.437 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 9.4 mp0 -62.33 -35.95 80.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.877 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.758 ' HB3' HD21 ' A' ' 8' ' ' LEU . 75.2 mt -76.39 -31.58 58.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.845 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 1.9 tt -64.71 -27.49 68.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.351 -0.841 . . . . 10.0 110.614 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . 0.517 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 19.8 ttp -60.51 -19.18 56.14 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.904 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.94 -34.19 74.33 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.689 -0.232 . . . . 10.0 111.106 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.69 -57.64 0.5 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.208 0.818 . . . . 10.0 113.208 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -81.91 38.6 0.53 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.954 0.407 . . . . 10.0 111.657 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.528 ' HD1' ' HB2' ' A' ' 8' ' ' LEU . 1.6 t80 . . . . . 0 C--O 1.244 0.806 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.578 -0.209 . . . . 10.0 112.578 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -59.22 4.46 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.743 0.646 . . . . 10.0 112.743 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.8 tp -62.04 -31.77 72.21 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.891 0.377 . . . . 10.0 110.836 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -56.34 -33.85 66.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.786 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -97.27 -40.36 8.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.891 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.57 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.6 mt -60.61 -39.33 87.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.953 -0.567 . . . . 10.0 112.441 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.43 -36.58 81.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 10.0 111.155 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 tp -69.89 -37.3 75.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.178 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.46 -22.03 61.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.352 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.54 -51.49 7.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.087 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.0 tp -141.61 112.92 7.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.958 -0.564 . . . . 10.0 111.524 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.557 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 26.7 mt -80.63 93.53 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 108.22 -1.03 . . . . 10.0 108.22 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.416 ' HD3' ' CB ' ' C' ' 83' ' ' LEU . 85.5 tttt -106.19 94.15 9.07 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.678 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.557 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 3.0 Cg_endo -87.19 88.98 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.995 2.463 . . . . 10.0 110.683 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -138.43 -176.79 4.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.992 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -89.11 158.94 17.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.192 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.3 mm -100.68 162.45 3.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.406 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.9 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 1.5 tmtm? -177.75 128.14 0.3 Allowed Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.9 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 64.9 Cg_exo -39.44 138.07 0.84 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.739 2.959 . . . . 10.0 113.421 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.705 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.2 Cg_endo -57.74 138.14 84.61 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.965 2.444 . . . . 10.0 112.211 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 14.0 mt -71.53 121.74 85.22 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 24.0 Cg_endo -62.38 -23.63 75.23 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.886 2.391 . . . . 10.0 112.248 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -35.38 77.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.247 0.546 . . . . 10.0 109.975 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -116.07 -132.78 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.355 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -160.75 52.69 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.327 0.584 . . . . 10.0 109.989 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.6 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 15.0 tttm -154.6 149.32 26.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.843 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.705 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 3.7 pp -73.77 156.08 38.21 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.506 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -171.52 1.99 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.504 -0.317 . . . . 10.0 110.502 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -130.38 129.11 42.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.815 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -169.28 -63.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.073 0.463 . . . . 10.0 110.609 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.79 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.065 -1.087 . . . . 10.0 108.065 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-N 114.757 -1.11 . . . . 10.0 109.006 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tmm? . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.568 0.223 . . . . 10.0 110.952 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.98 137.03 33.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.309 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.463 HG11 HD13 ' B' ' 57' ' ' LEU . 88.5 t -125.3 124.93 68.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.124 0.488 . . . . 10.0 111.263 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.739 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 61.8 m-85 -111.54 112.84 24.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.142 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.801 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -131.43 163.01 28.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.798 0.333 . . . . 10.0 111.191 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 34.7 mtm -128.54 108.27 10.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.2 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.43 HD13 ' HB ' ' B' ' 75' ' ' VAL . 49.7 mm -81.62 98.99 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.44 -0.948 . . . . 10.0 108.44 178.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.547 ' HA ' ' HA ' ' B' ' 13' ' ' THR . 71.0 ttt180 -98.58 103.54 15.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 113.016 0.747 . . . . 10.0 113.016 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.5 ' HB2' HD23 ' B' ' 77' ' ' LEU . 27.5 ttp85 -89.27 72.09 8.16 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.102 -1.444 . . . . 10.0 107.102 177.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 67.87 -85.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.058 -0.974 . . . . 10.0 110.139 -178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -107.94 -12.6 15.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.799 0.333 . . . . 10.0 111.108 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.481 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -95.65 91.75 6.27 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.094 -0.336 . . . . 10.0 110.094 179.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 5.2 m -94.57 120.24 34.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.005 0.431 . . . . 10.0 110.815 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.62 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 60.8 mt -109.99 119.38 58.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.685 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -74.34 117.22 15.9 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.801 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 0.9 OUTLIER -108.33 112.3 24.67 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.201 0.524 . . . . 10.0 111.813 -178.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.9 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.9 t70 -104.44 101.66 11.34 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.906 -1.146 . . . . 10.0 107.906 178.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -128.67 -167.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.871 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.409 ' O ' HD12 ' B' ' 57' ' ' LEU . 10.4 mmtt -123.48 161.7 24.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.47 -26.03 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.871 0.367 . . . . 10.0 111.63 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.82 -15.28 60.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.89 -0.596 . . . . 10.0 111.625 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 9.2 m -74.85 143.76 43.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.258 . . . . 10.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 19.2 p -94.94 165.9 12.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.822 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.433 HG13 HD12 ' B' ' 44' ' ' LEU . 53.9 t -63.99 -37.42 79.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.815 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -62.93 -35.1 78.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.451 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.439 ' O ' HG13 ' B' ' 30' ' ' ILE . 30.3 mt-10 -63.94 -36.11 82.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.419 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.944 HD11 HD21 ' B' ' 57' ' ' LEU . 63.6 mt -62.01 -44.6 96.37 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.04 -40.31 93.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.403 -0.817 . . . . 10.0 109.963 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -64.86 -37.15 86.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.272 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.439 HG13 ' O ' ' B' ' 26' ' ' GLU . 96.3 mt -64.13 -47.02 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 91.9 t -64.46 -33.74 64.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.248 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.756 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 6.8 tt0 -57.86 -40.02 79.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.629 179.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.53 -2.52 90.54 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.654 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.1 mt -106.8 -51.6 7.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.944 0.402 . . . . 10.0 111.281 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.58 -7.67 49.54 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.238 0.459 . . . . 10.0 112.238 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 62.39 29.48 17.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.932 0.396 . . . . 10.0 111.422 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.422 ' HA ' ' HD3' ' B' ' 37' ' ' ARG . 9.7 mmt180 -114.99 136.63 22.61 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.19 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.94 128.8 31.76 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.282 2.654 . . . . 10.0 112.684 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.756 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 51.5 Cg_endo -69.57 -14.46 36.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.384 2.723 . . . . 10.0 111.812 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.78 -43.72 85.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -99.12 14.54 28.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.921 -0.581 . . . . 10.0 112.096 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -87.07 127.2 35.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.211 -0.45 . . . . 10.0 109.929 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 31.8 mmt-85 -115.34 115.2 26.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.433 HD12 HG13 ' B' ' 24' ' ' VAL . 84.6 mt -97.29 115.09 27.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.224 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.16 111.6 22.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.06 0.457 . . . . 10.0 111.819 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.3 tttm -111.21 128.35 55.89 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.977 -1.12 . . . . 10.0 107.977 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 60.99 32.06 19.92 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.29 0.567 . . . . 10.0 109.776 -179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 68.34 17.45 9.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.148 -0.933 . . . . 10.0 111.791 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -125.31 149.99 47.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.071 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 28.8 tp -79.22 136.97 37.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.627 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 86.5 mt -86.26 174.86 8.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 10.0 111.736 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -110.57 125.48 53.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -62.26 -27.64 69.15 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.048 0.759 . . . . 10.0 113.048 -178.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.63 2.11 79.79 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.686 -0.768 . . . . 10.0 113.973 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -105.14 148.7 26.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.081 0.44 . . . . 10.0 111.282 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 34.7 p -83.85 166.85 17.58 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.882 179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.944 HD21 HD11 ' B' ' 27' ' ' LEU . 44.3 mt -57.94 -41.53 82.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.406 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.31 -45.82 93.74 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.795 -0.717 . . . . 10.0 111.81 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.87 -24.59 65.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.768 0.318 . . . . 10.0 111.157 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 84.8 m -84.53 5.04 29.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.927 0.394 . . . . 10.0 111.854 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.76 14.67 60.82 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.679 -0.772 . . . . 10.0 114.149 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -87.17 79.43 8.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 117.134 0.467 . . . . 10.0 110.748 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 73.3 p -97.64 167.67 10.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.02 -0.536 . . . . 10.0 109.88 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.51 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 10.0 111.281 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -77.08 -35.37 56.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.739 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -90.05 -32.73 16.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.042 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.739 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -110.09 98.87 8.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.272 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -114.73 155.26 46.45 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.297 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.493 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 29.0 Cg_endo -64.48 -16.49 55.41 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.229 1.952 . . . . 10.0 111.342 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -106.2 -1.03 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.466 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.978 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -158.04 88.44 2.39 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.879 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.533 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 2.6 Cg_exo -78.3 140.18 17.2 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.821 2.348 . . . . 10.0 111.18 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.25 114.55 6.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 10.0 111.459 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.75 114.05 9.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.497 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.43 ' HB ' HD13 ' B' ' 7' ' ' ILE . 51.4 t -116.42 133.54 62.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.05 135.42 13.69 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.2 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 9' ' ' ARG . 36.8 tp -114.38 107.06 15.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.792 0.33 . . . . 10.0 111.351 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.636 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -100.69 145.17 28.77 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -125.13 114.75 19.43 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 110.15 -0.315 . . . . 10.0 110.15 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -77.88 99.78 6.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.13 0.49 . . . . 10.0 111.44 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.408 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -117.74 128.54 54.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.21 131.91 51.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.822 0.304 . . . . 10.0 111.822 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 9.5 t70 73.27 -0.3 3.42 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.62 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 10.9 m -104.28 100.28 10.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.12 0.486 . . . . 10.0 110.518 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -67.78 -10.23 50.89 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.704 0.631 . . . . 10.0 112.704 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.426 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.7 tt0 -60.17 -22.84 63.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.877 0.37 . . . . 10.0 110.942 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.02 -29.85 68.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.043 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 65.3 mt -83.73 -32.42 25.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.76 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.1 m -66.19 -37.08 84.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.741 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.564 ' O ' ' HD3' ' B' ' 92' ' ' PRO . 2.4 mt -92.3 11.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.889 0.376 . . . . 10.0 111.585 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.5 101.49 17.63 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.821 0.343 . . . . 10.0 110.652 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' B' ' 90' ' ' ILE . 32.6 Cg_exo -63.84 -10.17 21.6 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.411 2.74 . . . . 10.0 112.8 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.01 -28.8 35.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.048 0.452 . . . . 10.0 110.999 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 11.8 m -113.84 -21.16 10.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.925 0.393 . . . . 10.0 111.596 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.463 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.8 m -126.57 149.25 67.47 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.376 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.89 162.42 41.98 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.634 2.223 . . . . 10.0 111.356 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.19 150.09 71.26 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.43 2.086 . . . . 10.0 111.652 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.55 84.41 3.93 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.291 0.567 . . . . 10.0 110.915 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 34.5 tp -108.49 122.46 40.26 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.115 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 22.8 Cg_exo -66.24 130.31 23.73 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.754 2.302 . . . . 10.0 111.06 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.65 -35.71 81.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.025 0.441 . . . . 10.0 111.145 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.516 HG23 ' HG2' ' B' ' 103' ' ' MET . 30.6 m -73.07 -18.48 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.753 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.548 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 90.0 mmm -111.53 28.55 8.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.754 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.52 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 88.0 tttt -94.76 -51.04 0.25 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 112.807 0.669 . . . . 10.0 112.807 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.52 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 10.7 Cg_exo -72.9 56.54 3.01 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 122.593 2.195 . . . . 10.0 112.403 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 14.5 mt-30 -132.29 127.91 36.64 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -73.98 146.77 43.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.859 0.361 . . . . 10.0 111.913 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 2.7 m -63.82 139.05 58.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.745 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.21 -117.62 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.867 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.66 -37.94 6.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.997 0.427 . . . . 10.0 111.089 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.978 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 13.8 m -95.13 169.78 9.87 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.782 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.46 142.1 39.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 70.92 -5.49 1.48 Allowed 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.573 0.546 . . . . 10.0 111.361 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -84.64 112.08 20.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.263 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.462 ' HB3' ' HB2' ' B' ' 106' ' ' GLN . 43.8 mt-30 -106.72 143.66 34.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.255 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.18 114.29 26.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.6 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -71.91 132.25 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.057 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.086 0.469 . . . . 10.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.683 0.278 . . . . 10.0 111.083 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.566 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.0 ttpt -113.2 113.43 25.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.45 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.427 HD22 ' HE2' ' C' ' 44' ' ' PHE . 40.0 mt -90.46 121.46 32.45 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 42.1 mt -106.04 130.0 58.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.088 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 1.4 p -101.3 170.63 8.11 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.625 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -59.15 -24.6 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -81.65 -2.65 51.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.319 . . . . 10.0 111.454 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.66 12.64 74.59 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.812 -0.709 . . . . 10.0 111.561 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.48 124.45 28.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.494 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 16.6 mt-10 -99.86 121.83 41.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.018 -179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -113.51 112.55 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.777 0.323 . . . . 10.0 111.504 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.62 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 13.8 mm -89.54 119.25 36.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 20.2 t -104.55 134.99 44.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.9 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 69.2 tttt -62.69 128.94 38.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' C' ' 15' ' ' ARG . 29.8 ttt180 -52.27 -38.04 57.13 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.379 0.424 . . . . 10.0 112.098 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.412 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.0 tt0 -54.59 -44.17 72.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.924 0.392 . . . . 10.0 111.206 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -80.22 -35.06 36.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.169 0.509 . . . . 10.0 110.215 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.36 87.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.51 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 74.6 mt -58.71 -50.67 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.585 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.26 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.486 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 22.2 m -64.99 -34.65 78.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.167 0.508 . . . . 10.0 109.858 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.87 -2.05 90.0 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.824 -0.625 . . . . 10.0 112.291 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -88.59 -23.4 23.12 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 17.3 mt -80.76 152.78 4.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -72.26 80.86 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 10.0 110.769 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.33 165.98 14.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.42 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 85.5 mmm -78.85 40.4 0.39 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.26 -24.76 64.02 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.344 -0.614 . . . . 10.0 109.344 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.33 14.36 13.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.01 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -59.22 -61.73 6.99 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 115.835 -0.621 . . . . 10.0 113.138 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -71.49 -165.87 0.22 Allowed 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.679 2.253 . . . . 10.0 112.243 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.0 -51.57 10.17 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.589 -0.815 . . . . 10.0 112.219 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -144.15 142.53 30.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.82 0.343 . . . . 10.0 110.233 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -114.22 88.45 2.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.757 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.84 161.53 30.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.077 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.35 -31.0 69.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.412 -0.358 . . . . 10.0 111.331 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -64.11 -38.5 91.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.152 0.501 . . . . 10.0 110.254 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.429 ' O ' HG22 ' C' ' 42' ' ' VAL . 22.0 tp10 -73.4 -24.69 60.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.637 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -78.34 -11.63 59.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.769 -0.65 . . . . 10.0 110.051 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -86.46 -55.34 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.674 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.566 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 53.9 mt-10 -129.75 91.65 3.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.359 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.429 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.7 t -78.24 124.38 36.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.309 -0.405 . . . . 10.0 109.961 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -98.79 106.26 18.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 10.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.474 ' HB3' HD12 ' C' ' 47' ' ' ILE . 81.1 m-85 -88.05 91.35 8.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.159 0.504 . . . . 10.0 110.939 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 47.8 mtt180 -76.09 134.91 39.9 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.29 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 4.7 mm-40 77.47 4.6 3.1 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 124.018 0.824 . . . . 10.0 112.174 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' C' ' 44' ' ' PHE . 72.8 mt -109.18 115.97 55.9 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.549 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' C' ' 47' ' ' ILE . 23.8 Cg_exo -67.31 151.25 80.99 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 123.104 2.536 . . . . 10.0 111.926 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.1 p -63.0 -37.87 88.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.64 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -55.66 -55.27 34.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.901 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.6 -31.6 53.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.627 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 25.8 tp -65.54 -40.01 92.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.934 0.397 . . . . 10.0 110.102 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -62.32 -34.93 77.58 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.113 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -64.95 -39.81 94.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.707 -0.678 . . . . 10.0 109.894 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.73 -49.22 76.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.361 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 63.3 m -57.01 -41.39 78.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.158 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -64.51 -41.11 96.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.128 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.57 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 78.1 t80 -65.48 -41.83 92.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.652 179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.462 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.9 m-85 -63.57 -45.04 92.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 46.4 m -59.33 -43.97 92.67 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.451 0.643 . . . . 10.0 109.68 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.493 ' HA ' ' HB2' ' B' ' 69' ' ' PRO . 36.9 t80 -63.76 -44.59 93.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.135 179.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -61.39 -40.39 94.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.938 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.462 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.6 t -57.16 -52.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.858 0.361 . . . . 10.0 110.589 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.2 mmt85 -70.81 -38.24 73.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.248 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.71 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 76.8 t80 -56.73 -50.24 72.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.045 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.84 -13.33 59.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.87 0.367 . . . . 10.0 111.84 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 37.3 t30 -88.64 -44.82 10.33 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -154.39 -31.0 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.873 0.694 . . . . 10.0 112.873 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.71 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 2.7 m -74.8 29.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.59 0.589 . . . . 10.0 112.59 -179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.1 -1.22 39.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.216 0.531 . . . . 10.0 110.399 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -76.5 -24.52 53.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.396 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.488 HG12 ' O ' ' C' ' 69' ' ' SER . 31.7 pt -96.13 166.17 14.87 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.428 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.86 175.74 8.58 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.928 2.419 . . . . 10.0 112.661 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -72.59 171.72 11.92 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.476 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -50.77 128.6 27.18 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.675 0.274 . . . . 10.0 111.043 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -53.89 128.01 27.91 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 123.185 2.59 . . . . 10.0 112.979 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.58 HG22 ' HA ' ' A' ' 16' ' ' LEU . 17.1 pt -85.48 41.72 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.149 0.499 . . . . 10.0 111.113 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -90.96 -55.89 0.26 Allowed Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.96 -0.563 . . . . 10.0 112.456 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 8.4 Cg_exo -72.14 128.58 14.05 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.888 1.725 . . . . 10.0 111.011 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -75.2 0.46 16.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 47.0 mm -85.85 99.35 7.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.272 0.558 . . . . 10.0 111.35 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -168.02 -42.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.049 -0.978 . . . . 10.0 109.457 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.416 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 29.1 tp -65.84 -26.86 67.85 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.622 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 29.6 mp0 -62.91 -31.84 72.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.9 -1.045 . . . . 10.0 109.884 178.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.705 ' HB3' HD21 ' A' ' 8' ' ' LEU . 66.4 mt -79.72 -35.12 39.41 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.967 -0.753 . . . . 10.0 108.967 179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -23.99 67.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.403 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 49.5 ttp -58.99 -28.95 66.85 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.269 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . 0.51 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -58.03 -43.07 86.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.608 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 69.16 -52.42 0.59 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.164 1.172 . . . . 10.0 114.164 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -79.61 25.15 0.34 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.294 0.479 . . . . 10.0 112.294 -178.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.51 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 58.7 m-85 . . . . . 0 C--O 1.244 0.791 0 CA-C-O 118.699 -0.667 . . . . 10.0 109.625 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.539 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.172 -0.371 . . . . 10.0 112.172 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.453 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.44 -62.89 1.53 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.265 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' C' ' 85' ' ' LEU . 37.3 tp -61.01 -34.01 74.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.982 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.427 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 60.3 tt0 -58.53 -30.23 66.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.133 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -98.63 -38.32 9.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.02 0.438 . . . . 10.0 110.473 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.507 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 77.5 mt -63.4 -35.7 81.29 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.94 -0.573 . . . . 10.0 112.233 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.38 92.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 10.0 110.329 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.6 tp -70.99 -22.83 62.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.125 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.17 -9.54 59.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.309 179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.467 ' HB2' ' CE1' ' C' ' 58' ' ' TYR . . . -105.14 -51.16 3.08 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.407 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' C' ' 77' ' ' ILE . 0.2 OUTLIER -137.2 129.11 29.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.736 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.407 ' H ' HD12 ' A' ' 17' ' ' ILE . 2.5 mp -91.28 97.65 7.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 52.4 tttt -111.53 103.68 55.32 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.951 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -97.05 45.17 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.429 2.753 . . . . 10.0 111.611 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.555 ' CD ' ' HE3' ' A' ' 18' ' ' LYS . 28.9 mttt -93.28 -178.08 4.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.413 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -82.33 147.86 28.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.21 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.444 HD11 ' HG ' ' C' ' 83' ' ' LEU . 30.7 mm -110.33 106.45 20.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.15 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.006 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.5 OUTLIER -121.87 135.49 25.32 Favored Pre-proline 0 C--N 1.32 -0.695 0 N-CA-C 109.025 -0.731 . . . . 10.0 109.025 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.538 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 35.4 Cg_exo -34.25 135.12 0.13 Allowed 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 124.176 3.251 . . . . 10.0 113.6 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.723 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 13.4 Cg_endo -56.64 141.09 91.49 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 123.293 2.662 . . . . 10.0 112.511 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.434 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -78.81 118.42 72.31 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.763 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 19.9 Cg_endo -59.98 -21.27 64.22 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.391 2.727 . . . . 10.0 113.165 -179.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -63.97 -34.55 78.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.818 0.342 . . . . 10.0 111.095 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.668 HG13 ' HB ' ' B' ' 102' ' ' VAL . 3.3 t -122.68 -112.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -175.21 61.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.185 0.517 . . . . 10.0 111.095 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.3 tttm -159.85 151.87 20.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.447 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.723 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -70.76 156.64 39.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.818 0.342 . . . . 10.0 110.744 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -103.01 170.81 7.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.107 -179.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -119.88 111.89 18.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.844 0.354 . . . . 10.0 110.741 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.006 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -151.57 -72.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.183 -179.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.41 -62.63 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.309 -0.853 . . . . 10.0 109.511 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.877 0.37 . . . . 10.0 111.022 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -166.69 121.72 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.671 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.27 117.14 48.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.996 0.427 . . . . 10.0 110.856 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.42 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 68.8 m-85 -104.25 115.47 30.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.653 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.746 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -130.71 156.33 45.12 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.892 0.377 . . . . 10.0 111.37 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.555 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 55.2 mtm -125.61 111.81 15.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.874 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.548 HD13 ' HB ' ' B' ' 75' ' ' VAL . 42.8 mm -82.19 104.32 10.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -100.27 97.39 8.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.547 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 17.0 ttp85 -89.19 75.71 7.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.7 -1.222 . . . . 10.0 107.7 177.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.62 ' HB2' HG12 ' B' ' 90' ' ' ILE . 22.3 t-80 67.13 -87.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.448 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -113.67 11.09 18.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.931 0.396 . . . . 10.0 111.001 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 5.8 m -116.61 96.92 5.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.383 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.423 ' OG1' ' HE1' ' C' ' 9' ' ' HIS . 24.6 m -96.13 121.14 37.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.897 0.38 . . . . 10.0 110.933 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.567 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.1 mt -112.21 119.19 59.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.358 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.16 122.84 26.18 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.746 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -116.6 118.39 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.036 0.446 . . . . 10.0 112.003 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -103.4 101.58 11.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.96 -169.4 2.03 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.275 0.36 . . . . 10.0 110.784 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -127.54 163.82 23.33 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.6 -25.83 64.95 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -18.94 60.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.839 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.406 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 10.8 m -71.68 141.26 49.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.615 -0.266 . . . . 10.0 110.729 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 20.3 p -91.78 163.96 13.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.625 -0.261 . . . . 10.0 110.63 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.432 HG21 ' HB3' ' B' ' 51' ' ' LEU . 65.2 t -63.78 -36.32 76.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.925 0.393 . . . . 10.0 110.577 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -61.29 -36.13 79.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.645 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -63.33 -34.26 77.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.171 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.67 HD11 HD21 ' B' ' 57' ' ' LEU . 75.1 mt -61.58 -42.58 99.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.438 -0.579 . . . . 10.0 109.438 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.0 -32.03 73.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.283 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' B' ' 29' ' ' ARG . 19.0 mtp180 -66.08 -39.5 90.09 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 70.1 mt -67.33 -43.46 87.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 27' ' ' LEU . 93.6 t -61.57 -38.09 79.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.432 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 38.4 tt0 -62.41 -30.12 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.537 . . . . 10.0 110.271 178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.73 -0.14 86.2 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.869 -0.682 . . . . 10.0 112.362 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 89.9 mt -115.64 -55.29 4.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 10.0 111.079 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 66.4 mt -88.42 -11.5 45.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.453 -0.339 . . . . 10.0 111.138 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 46.4 mttt 55.7 52.84 10.31 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.918 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.63 146.57 62.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.689 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -54.49 121.76 10.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.963 2.442 . . . . 10.0 112.268 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.74 -16.65 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.783 2.322 . . . . 10.0 111.928 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -26.75 65.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.387 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -101.22 9.62 41.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.229 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -95.03 131.12 41.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.889 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.453 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 56.8 mmt-85 -117.9 114.26 22.96 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 82.1 mt -94.15 117.77 30.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.779 0.324 . . . . 10.0 110.56 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -111.44 124.5 52.39 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 112.268 -179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 38.9 tttm -127.22 128.34 45.9 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 61.59 31.66 18.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.899 0.381 . . . . 10.0 110.642 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 70.91 13.44 7.04 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.378 -0.828 . . . . 10.0 111.89 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -124.25 144.89 49.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.804 0.335 . . . . 10.0 111.039 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 42.4 tp -73.26 127.69 33.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.502 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.432 ' HB3' HG21 ' B' ' 24' ' ' VAL . 97.1 mt -70.46 155.76 40.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.027 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 20.3 t0 -87.27 118.21 26.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.647 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.81 -28.1 68.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.825 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.91 24.39 32.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.698 -0.763 . . . . 10.0 113.454 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 23.8 mttp -127.78 160.16 32.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.963 0.411 . . . . 10.0 111.02 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 35.0 p -89.12 166.59 13.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.215 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.67 HD21 HD11 ' B' ' 27' ' ' LEU . 44.0 mt -59.35 -40.53 86.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.01 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.07 -39.9 96.38 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.875 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -72.83 -17.39 61.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.962 0.41 . . . . 10.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 60.2 m -94.91 5.96 50.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.728 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.52 16.89 63.17 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.71 -0.757 . . . . 10.0 113.355 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.431 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 36.9 m-85 -84.64 63.62 8.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.151 0.5 . . . . 10.0 110.451 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 3.5 p -84.85 149.83 25.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.12 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 2.3 m -62.49 -21.58 65.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.992 0.425 . . . . 10.0 110.673 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -63.76 -30.26 71.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.208 -0.451 . . . . 10.0 109.904 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.16 5.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.751 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.42 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -90.58 87.84 6.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.164 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -100.11 159.55 29.51 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.713 -0.676 . . . . 10.0 111.112 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.86 -16.76 55.84 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.638 2.225 . . . . 10.0 111.897 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.412 ' HB2' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER -113.67 5.95 16.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.442 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.606 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -156.26 79.05 4.08 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.339 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.555 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.6 Cg_exo -74.29 141.78 29.37 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.612 2.208 . . . . 10.0 111.545 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.09 123.53 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.069 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 123.6 24.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.571 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.548 ' HB ' HD13 ' B' ' 7' ' ' ILE . 21.0 t -123.77 129.19 74.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.55 133.43 11.8 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.697 -0.763 . . . . 10.0 111.896 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 52.4 tp -110.29 99.1 8.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.009 0.433 . . . . 10.0 111.116 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.453 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -95.65 114.3 26.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.013 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -97.84 118.77 35.15 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -83.46 100.86 11.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.146 0.498 . . . . 10.0 111.244 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -120.36 141.11 50.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.695 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.61 137.51 54.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 4.7 t70 70.79 11.81 7.16 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.409 0.623 . . . . 10.0 110.854 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 9.4 m -111.68 98.85 7.7 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.214 0.531 . . . . 10.0 111.063 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -72.78 -17.92 61.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.576 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 30.0 tt0 -56.98 -26.05 59.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.672 -0.695 . . . . 10.0 110.641 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.67 -16.8 61.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.71 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 58.7 mt -93.4 -15.57 25.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.949 0.404 . . . . 10.0 111.345 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 24.0 m -91.93 -30.26 16.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.115 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.62 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.2 mt -85.45 -3.3 8.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.29 0.567 . . . . 10.0 110.597 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -100.38 110.29 59.59 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.152 -0.477 . . . . 10.0 111.079 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 59.7 Cg_endo -72.72 -1.67 10.71 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.027 2.485 . . . . 10.0 111.736 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -84.57 -24.37 29.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.444 -0.798 . . . . 10.0 109.195 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -112.79 -39.4 4.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.599 -0.728 . . . . 10.0 111.064 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 25.5 m -117.34 155.62 49.79 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.978 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.16 154.98 42.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.558 2.172 . . . . 10.0 111.912 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -55.44 135.22 68.15 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.855 2.37 . . . . 10.0 112.014 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -76.69 106.08 8.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.316 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 27.4 tp -141.64 121.29 8.2 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.687 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 26.0 Cg_exo -64.81 133.15 35.13 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.535 2.157 . . . . 10.0 111.687 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -60.72 -27.67 68.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.53 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.668 ' HB ' HG13 ' A' ' 29' ' ' VAL . 18.1 m -65.02 -25.14 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.279 0.561 . . . . 10.0 110.586 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.493 ' HG2' HG23 ' B' ' 102' ' ' VAL . 83.4 mmm -121.47 54.88 1.1 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.281 -1.007 . . . . 10.0 108.281 179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.648 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 69.7 tttt -126.87 -54.96 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.465 -0.789 . . . . 10.0 112.445 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 3.5 Cg_exo -82.23 70.11 7.18 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.633 2.222 . . . . 10.0 111.645 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -128.64 -167.41 1.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.993 -0.548 . . . . 10.0 109.796 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.784 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.6 t70 -93.41 179.78 5.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 8.6 m -110.7 136.57 49.58 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.66 0.267 . . . . 10.0 110.402 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -86.35 -147.71 11.07 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.511 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 3.6 m -111.66 -22.47 11.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.334 0.588 . . . . 10.0 110.348 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.625 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 1.0 OUTLIER -86.63 159.79 19.1 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.604 -0.725 . . . . 10.0 109.918 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . 0.606 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -64.4 121.95 15.58 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 t30 69.94 17.28 7.51 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.782 0.677 . . . . 10.0 111.572 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.625 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 65.4 tt0 -81.78 129.54 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.995 0.426 . . . . 10.0 110.249 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -110.13 143.04 40.79 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.097 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -114.09 105.76 13.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.353 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.418 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 1.9 t -72.38 137.65 23.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.911 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.447 ' NE2' ' HB2' ' B' ' 107' ' ' ASP . 22.5 mp0 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.494 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.89 0.376 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -104.16 108.36 19.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.174 -0.467 . . . . 10.0 111.181 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.704 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 47.8 mt -81.8 126.66 32.12 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.527 HD11 ' HB3' ' C' ' 41' ' ' GLU . 40.9 mt -108.13 114.14 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.813 0.34 . . . . 10.0 110.582 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.66 165.66 16.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.674 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m -61.65 -25.68 67.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.908 0.385 . . . . 10.0 111.655 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -79.02 0.15 28.86 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.647 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 78.71 26.22 59.15 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . 0.423 ' HE1' ' OG1' ' B' ' 13' ' ' THR . 6.8 t-80 -91.08 138.79 31.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.44 . . . . 10.0 110.381 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.58 132.53 49.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.316 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.704 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 59.9 m-85 -125.12 106.85 10.22 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.257 -0.428 . . . . 10.0 109.983 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.567 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 27.4 mm -88.68 110.81 21.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.148 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 43.1 t -98.51 125.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.04 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -59.74 128.25 35.99 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.298 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.46 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 33.0 ttt-85 -53.28 -31.26 42.94 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.33 -0.395 . . . . 10.0 111.639 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -52.34 -44.8 65.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.078 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -87.09 -30.03 21.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.514 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -62.42 -32.44 73.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.025 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 73.2 mt -59.1 -46.87 87.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.739 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.439 ' HB ' HG22 ' C' ' 63' ' ' VAL . 4.6 m -72.61 -36.21 68.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.408 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 27.5 m -65.26 -24.07 67.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.146 0.498 . . . . 10.0 110.301 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.71 -8.33 82.96 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.817 -0.629 . . . . 10.0 111.694 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -87.74 -19.57 27.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.454 0.645 . . . . 10.0 109.584 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -79.21 148.35 6.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.313 -0.858 . . . . 10.0 109.312 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.7 79.8 0.84 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 10.0 110.697 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -90.01 172.87 8.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.313 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.539 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 97.8 mmm -82.87 38.59 0.59 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.11 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mp -66.8 -32.57 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.288 0.566 . . . . 10.0 109.811 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -90.17 14.54 12.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.957 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.56 -62.5 3.83 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.657 -0.701 . . . . 10.0 112.89 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.99 -167.5 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.726 2.284 . . . . 10.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.63 -90.01 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.962 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -116.08 132.33 56.69 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.706 -0.291 . . . . 10.0 110.534 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.76 92.95 8.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.306 -0.406 . . . . 10.0 109.987 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.73 176.51 8.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.187 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.37 -25.74 68.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.268 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.86 -48.07 78.18 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.458 ' O ' HG22 ' C' ' 42' ' ' VAL . 8.2 mp0 -70.46 -24.45 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.246 -0.888 . . . . 10.0 111.324 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 5.1 m -78.29 -47.05 18.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.017 0.437 . . . . 10.0 110.621 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -70.83 -44.16 67.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.878 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.527 ' HB3' HD11 ' C' ' 4' ' ' ILE . 49.5 mt-10 -128.62 103.27 7.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.436 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.458 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.9 t -90.01 104.69 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . 0.431 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 14.6 t-20 -84.22 128.5 34.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.669 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.538 ' HE2' ' HB3' ' C' ' 3' ' ' LEU . 81.4 m-85 -109.15 124.43 50.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.345 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -96.41 128.1 43.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.334 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 67.48 19.76 9.93 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 10.0 112.79 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' C' ' 44' ' ' PHE . 67.2 mt -113.45 111.4 49.54 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.212 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.7 143.57 46.68 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 123.038 2.492 . . . . 10.0 111.645 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -34.9 70.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.904 -179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.11 -55.54 31.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 10.0 111.742 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 30.6 m -71.33 -30.42 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.99 -0.284 . . . . 10.0 111.002 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 43.9 tp -64.34 -35.9 82.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.447 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -59.59 -39.76 85.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.589 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -65.73 -36.18 82.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.315 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 36.3 t -68.53 -44.28 83.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.64 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.28 -42.3 98.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.614 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 72.1 mtm -66.4 -35.21 79.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.467 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.507 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 75.7 t80 -65.21 -42.65 93.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 10.0 110.174 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.47 ' O ' HG23 ' C' ' 63' ' ' VAL . 9.5 m-85 -62.39 -47.44 84.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.703 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.0 m -57.53 -42.46 82.92 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.944 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -64.48 -45.57 86.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.364 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptt -63.79 -34.83 78.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 10.0 112.006 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.47 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -62.01 -40.76 88.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.102 0.477 . . . . 10.0 110.52 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -84.52 -34.45 23.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.737 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.701 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 45.9 t80 -57.71 -57.33 13.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.027 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.97 54.47 3.1 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 0.8 OUTLIER -162.16 -58.87 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.322 -179.049 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.58 -33.82 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.634 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.701 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 7.2 m -87.12 35.32 0.7 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.082 0.468 . . . . 10.0 111.949 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -9.76 59.09 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.012 0.434 . . . . 10.0 110.535 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -92.95 -9.54 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.658 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 34.1 pt -100.17 164.36 16.53 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.155 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.61 164.23 27.2 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.625 2.217 . . . . 10.0 112.948 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.8 tp10 -72.63 170.63 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.315 178.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.477 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 29.9 t80 -48.15 128.24 12.3 Favored Pre-proline 0 C--O 1.233 0.197 0 O-C-N 123.295 0.372 . . . . 10.0 110.824 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.96 121.77 5.45 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.545 2.83 . . . . 10.0 113.395 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.576 ' HA ' ' HG ' ' A' ' 16' ' ' LEU . 2.7 pt -80.15 45.81 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.576 -0.738 . . . . 10.0 111.855 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.638 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -102.21 -57.5 0.1 Allowed Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 112.724 0.639 . . . . 10.0 112.724 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.638 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 2.6 Cg_exo -76.37 97.01 1.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.202 1.935 . . . . 10.0 111.59 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.77 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -74.28 59.81 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.684 0.624 . . . . 10.0 112.684 -179.525 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 7.1 mm -116.25 13.73 7.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.879 0.847 . . . . 10.0 108.942 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.56 -38.43 54.98 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.431 -0.804 . . . . 10.0 111.328 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 15.4 tp -66.58 -30.07 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.137 0.494 . . . . 10.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.542 ' HA ' ' CD2' ' A' ' 32' ' ' LEU . 17.5 mp0 -61.42 -35.77 78.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.397 -0.82 . . . . 10.0 109.827 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 8' ' ' LEU . 46.5 mt -80.73 -33.55 35.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.335 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 3.3 tt -63.13 -27.15 69.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.685 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 35.2 ttp -59.5 -20.73 57.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.767 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -42.06 88.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.606 0.241 . . . . 10.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.59 -50.94 0.51 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -79.98 12.15 2.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.883 0.373 . . . . 10.0 111.586 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.53 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 72.6 m-85 . . . . . 0 C--O 1.244 0.8 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.329 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.425 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.316 -0.314 . . . . 10.0 112.316 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -67.93 0.28 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.164 0.801 . . . . 10.0 113.164 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' C' ' 85' ' ' LEU . 41.8 tp -63.95 -32.31 73.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.585 -0.279 . . . . 10.0 111.514 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.408 ' HG3' ' HG ' ' C' ' 86' ' ' LEU . 63.0 tt0 -57.6 -42.77 83.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.041 0.448 . . . . 10.0 110.25 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -78.88 -40.28 32.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.994 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.447 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 83.4 mt -61.02 -32.77 72.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.62 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.86 -43.52 92.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.791 0.329 . . . . 10.0 110.544 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.2 tp -70.27 -22.73 62.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.44 0.638 . . . . 10.0 109.956 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.77 2.23 56.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.368 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -114.07 -39.41 3.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.157 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.7 OUTLIER -156.68 118.91 3.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.959 -0.564 . . . . 10.0 111.016 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.1 mt -86.48 85.57 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' C' ' 80' ' ' GLU . 13.9 ttpt -96.21 111.89 57.98 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.159 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -95.46 36.04 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.315 2.677 . . . . 10.0 111.352 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -82.29 -177.95 6.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.341 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.836 ' HB2' ' HG3' ' A' ' 34' ' ' GLU . 28.4 mm-40 -87.35 166.03 15.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.547 0.573 . . . . 10.0 112.547 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.0 mm -116.41 143.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.691 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.122 ' HD3' ' HD2' ' A' ' 24' ' ' PRO . 0.1 OUTLIER -168.83 143.03 2.52 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 1.122 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 65.8 Cg_exo -43.74 140.28 4.72 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.258 2.639 . . . . 10.0 112.526 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.817 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 30.2 Cg_endo -63.84 139.28 67.64 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.859 2.373 . . . . 10.0 111.826 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -76.44 125.72 87.19 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.66 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.59 -11.03 30.09 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.097 2.531 . . . . 10.0 112.936 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 -42.38 76.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.135 0.493 . . . . 10.0 110.478 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -119.5 -125.51 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -159.41 55.56 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.38 0.61 . . . . 10.0 110.727 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HD2' ' HB ' ' B' ' 117' ' ' VAL . 17.9 tttm -153.06 154.11 34.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.408 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.817 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -76.52 156.38 32.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.716 0.293 . . . . 10.0 110.935 179.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -95.53 169.91 9.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.601 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.836 ' HG3' ' HB2' ' A' ' 21' ' ' GLN . 25.1 tt0 -122.32 119.41 31.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.03 0.443 . . . . 10.0 110.967 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.086 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -153.17 -68.25 0.15 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.991 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.0 -56.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.806 -0.616 . . . . 10.0 109.875 179.908 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tmm? . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 121.02 0.438 . . . . 10.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -79.23 137.17 37.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.003 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.572 HG11 HD13 ' B' ' 57' ' ' LEU . 98.3 t -123.6 119.49 57.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.29 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.555 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 54.6 m-85 -109.3 115.03 29.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.994 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.792 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.8 OUTLIER -131.13 159.75 36.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.811 0.339 . . . . 10.0 111.39 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 35.0 mtm -127.52 106.17 8.99 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.862 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' B' ' 75' ' ' VAL . 45.8 mm -78.36 105.39 7.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -107.62 104.15 13.62 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.83 0.678 . . . . 10.0 112.83 -178.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.45 ' HB2' HD23 ' B' ' 77' ' ' LEU . 16.5 ttp85 -92.54 76.39 5.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.339 -1.356 . . . . 10.0 107.339 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.722 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.4 t-80 67.6 -81.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.428 -0.805 . . . . 10.0 111.083 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 mttt -113.87 -12.65 12.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.94 0.4 . . . . 10.0 111.743 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.5 105.14 17.37 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.571 -0.529 . . . . 10.0 109.571 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.6 m -106.68 120.48 42.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.63 0.253 . . . . 10.0 111.24 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.48 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 58.3 mt -113.44 118.09 57.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.429 -0.35 . . . . 10.0 110.81 -179.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -77.26 118.42 19.73 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.792 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -110.02 116.74 32.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.448 0.642 . . . . 10.0 112.003 -178.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.836 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 5.0 t70 -101.59 97.99 8.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.706 -1.22 . . . . 10.0 107.706 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.44 -169.69 1.9 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.222 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -127.43 158.49 37.2 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.73 -20.7 61.81 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.467 0.543 . . . . 10.0 112.467 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.19 -15.29 58.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.835 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 20.1 m -81.09 143.27 32.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.742 0.306 . . . . 10.0 111.367 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 40.0 p -90.55 168.28 11.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.455 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 57.2 t -64.63 -34.32 69.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.638 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -62.2 -35.94 80.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.412 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -63.5 -29.8 71.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.105 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.927 HD11 HD21 ' B' ' 57' ' ' LEU . 81.1 mt -67.21 -47.31 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -61.36 -33.34 73.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.877 -0.602 . . . . 10.0 110.573 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.55 -34.31 77.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.138 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.1 mt -70.57 -46.85 68.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 61.2 t -61.67 -36.41 73.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.327 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -57.58 -40.25 78.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.69 -14.66 79.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.85 -0.691 . . . . 10.0 113.241 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 88.0 mt -95.42 -51.94 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 122.663 -0.316 . . . . 10.0 111.399 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 46.1 mt -85.54 -11.63 53.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.452 0.538 . . . . 10.0 112.452 -178.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 46.7 mttm 60.92 41.24 14.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' B' ' 37' ' ' ARG . 47.5 mtt-85 -131.82 151.55 78.76 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.85 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.42 131.51 46.67 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.308 2.672 . . . . 10.0 112.589 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.46 ' HA ' ' NE2' ' B' ' 42' ' ' GLN . 72.6 Cg_endo -77.95 -20.9 11.33 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.877 2.384 . . . . 10.0 111.971 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -70.68 -23.74 62.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -98.87 11.41 38.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.349 0.595 . . . . 10.0 111.194 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . 0.46 ' NE2' ' HA ' ' B' ' 39' ' ' PRO . 77.1 mt-30 -99.42 133.33 43.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.469 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.554 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 47.5 mmt-85 -115.0 118.22 32.8 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.759 . . . . 10.0 108.952 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.492 ' HB3' HD12 ' B' ' 51' ' ' LEU . 41.1 mt -96.93 114.18 25.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.844 0.354 . . . . 10.0 111.144 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -112.33 127.23 55.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.137 0.494 . . . . 10.0 111.569 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -137.22 128.82 28.57 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.31 39.05 15.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.91 0.386 . . . . 10.0 111.214 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 64.27 17.06 10.51 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.353 -0.839 . . . . 10.0 111.808 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -128.72 155.19 45.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.858 0.361 . . . . 10.0 111.286 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.94 133.71 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.492 HD12 ' HB3' ' B' ' 44' ' ' LEU . 94.9 mt -76.77 155.95 32.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.835 0.35 . . . . 10.0 111.511 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -100.95 114.1 27.69 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.366 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.65 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 2.3 m-20 -64.86 -15.7 62.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.725 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.88 14.54 64.55 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.885 -0.674 . . . . 10.0 112.751 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -130.72 160.9 32.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.753 0.311 . . . . 10.0 110.693 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.781 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 43.4 p -86.6 165.56 16.09 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.334 -0.393 . . . . 10.0 110.405 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.927 HD21 HD11 ' B' ' 27' ' ' LEU . 84.7 mt -57.63 -39.68 77.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.398 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.06 85.33 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.998 -0.62 . . . . 10.0 112.382 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -81.15 -12.98 59.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.905 0.383 . . . . 10.0 111.507 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . 0.441 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 57.8 m -96.83 2.27 51.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 10.0 111.105 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.41 9.09 62.04 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.736 -0.745 . . . . 10.0 113.32 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.523 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 69.8 m-85 -86.28 62.6 7.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.233 0.539 . . . . 10.0 110.39 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.7 p -88.21 154.2 20.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.544 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 14.9 m -61.76 -15.36 40.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.053 0.454 . . . . 10.0 111.313 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -72.18 -38.21 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.263 0.554 . . . . 10.0 109.966 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.08 -46.11 7.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.554 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.555 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -87.76 92.85 9.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -99.4 154.11 37.45 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.17 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.96 -13.62 38.45 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.87 2.38 . . . . 10.0 112.078 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.457 ' HB3' ' CD1' ' C' ' 61' ' ' TYR . 3.9 pt20 -110.39 0.69 18.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.217 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.493 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -157.9 89.27 2.37 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.586 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.548 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.9 Cg_exo -74.03 141.78 30.22 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.742 2.295 . . . . 10.0 111.568 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.13 116.44 12.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.891 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.34 128.2 35.51 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.555 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.521 ' HB ' HD13 ' B' ' 7' ' ' ILE . 24.3 t -125.42 131.34 72.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.061 -0.718 . . . . 10.0 109.061 179.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.99 122.82 6.42 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.669 -0.777 . . . . 10.0 111.877 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' B' ' 9' ' ' ARG . 42.6 tp -101.53 106.16 17.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.843 0.354 . . . . 10.0 111.128 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.554 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -101.07 105.51 16.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.458 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.04 117.65 30.04 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.917 -0.401 . . . . 10.0 109.917 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -81.7 106.19 13.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.008 0.432 . . . . 10.0 111.573 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -117.78 128.18 54.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -62.3 143.2 57.21 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.917 -0.313 . . . . 10.0 111.276 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.29 -3.39 1.85 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.515 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.46 96.17 5.29 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.914 -0.584 . . . . 10.0 109.539 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -77.72 12.65 1.59 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.955 -178.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -62.84 -26.83 68.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.65 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.08 78.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.972 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -70.0 -33.16 71.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.795 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 3.7 m -74.71 -30.78 61.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.774 -0.648 . . . . 10.0 111.21 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.722 HG12 ' HB2' ' B' ' 10' ' ' HIS . 59.0 mt -84.33 -35.29 10.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.252 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 28.6 tt0 -61.04 115.36 13.79 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.633 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.604 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.9 Cg_exo -65.93 -14.96 46.97 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.294 2.663 . . . . 10.0 112.51 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.59 -37.65 62.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.026 0.441 . . . . 10.0 110.147 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.37 -35.91 12.16 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.657 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.604 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 1.4 m -128.53 144.62 52.78 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.508 -0.314 . . . . 10.0 111.192 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.33 145.82 60.88 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.377 2.052 . . . . 10.0 111.083 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.66 128.61 28.92 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.896 2.397 . . . . 10.0 111.624 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -63.01 111.01 1.99 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.918 -0.583 . . . . 10.0 112.174 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 26.4 tp -131.08 131.56 23.25 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.048 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.506 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 31.3 Cg_exo -62.52 128.65 24.14 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 122.686 2.257 . . . . 10.0 111.733 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -65.41 -37.65 87.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.439 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.401 HG23 ' HG2' ' B' ' 103' ' ' MET . 28.1 m -67.22 -20.86 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.318 0.58 . . . . 10.0 110.694 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.506 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.3 mmm -114.65 52.98 0.82 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.027 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.714 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 33.1 tttm -126.27 -54.22 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 112.778 0.658 . . . . 10.0 112.778 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.714 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 72.8 Cg_endo -74.84 63.35 5.84 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.098 1.865 . . . . 10.0 111.858 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -128.92 -173.93 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.813 -0.631 . . . . 10.0 109.609 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.853 ' HB2' HE22 ' B' ' 118' ' ' GLN . 1.2 t70 -96.92 178.58 5.24 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.706 -0.397 . . . . 10.0 111.096 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.4 m -96.44 139.61 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.723 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . 0.424 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -89.13 -156.71 32.01 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.26 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.84 -34.23 16.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.092 0.472 . . . . 10.0 110.553 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.54 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 50.9 m -84.48 162.82 19.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.067 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . 0.493 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -70.18 129.08 38.41 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 73.17 4.45 4.9 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.757 0.661 . . . . 10.0 111.511 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.54 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 35.2 tt0 -75.4 141.06 43.3 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -118.19 147.19 43.61 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.091 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -120.32 109.86 15.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.225 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.482 ' HB ' ' HD2' ' A' ' 31' ' ' LYS . 2.2 t -77.23 137.41 22.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.122 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.853 HE22 ' HB2' ' B' ' 107' ' ' ASP . 16.3 mp0 . . . . . 0 C--N 1.323 -0.545 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.859 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.235 0.304 0 CA-C-O 120.932 0.396 . . . . 10.0 110.732 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.497 ' HE2' ' HG2' ' C' ' 41' ' ' GLU . 37.9 ttpt -102.42 111.15 23.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.956 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 66.3 mt -92.2 111.37 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 8.2 mt -97.37 122.43 48.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.975 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 10.3 p -95.34 171.47 8.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.804 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.8 m -70.19 -7.59 43.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.839 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -91.64 -3.63 56.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.01 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.39 5.66 84.78 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.16 -0.776 . . . . 10.0 111.16 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.11 121.2 26.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.489 -0.56 . . . . 10.0 109.489 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -102.52 120.47 40.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.274 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -106.9 123.57 48.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.211 -0.45 . . . . 10.0 111.547 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 17.4 mm -100.7 117.69 46.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.844 -0.798 . . . . 10.0 108.844 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.15 139.68 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.603 -0.147 . . . . 10.0 110.603 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.836 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 56.2 tttt -56.44 130.41 44.72 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.405 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 33.7 ttt180 -53.99 -37.99 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.759 0.281 . . . . 10.0 111.759 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.519 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 35.2 tt0 -55.84 -53.21 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.93 0.395 . . . . 10.0 110.842 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -66.77 -36.57 82.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.717 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.14 86.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.827 179.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 69.5 mt -61.27 -52.02 66.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.701 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.401 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.8 m -60.81 -41.43 95.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.731 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 28.8 m -64.74 -39.28 93.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.715 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -73.76 -10.88 80.64 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.121 -0.561 . . . . 10.0 112.662 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 25.1 m -82.69 -15.26 52.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.508 0.671 . . . . 10.0 109.743 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.1 mt -88.34 159.63 2.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -67.33 86.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.105 0.479 . . . . 10.0 111.435 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -98.92 165.91 11.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.969 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.425 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 96.3 mmm -76.8 41.89 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.92 -28.68 66.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.263 0.554 . . . . 10.0 109.835 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.89 15.49 22.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.236 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.45 -64.54 3.92 Favored Glycine 0 CA--C 1.52 0.391 0 CA-C-N 115.758 -0.655 . . . . 10.0 113.039 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.72 -154.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.612 2.208 . . . . 10.0 111.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.57 -94.95 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.743 -0.741 . . . . 10.0 112.089 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -113.41 112.01 22.92 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.827 0.346 . . . . 10.0 110.728 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -81.6 100.71 9.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.528 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.07 156.56 39.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.619 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -57.78 -37.29 73.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.073 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -62.96 -36.53 83.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -71.7 -31.5 66.82 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.206 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -73.75 -32.93 64.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.979 0.419 . . . . 10.0 110.306 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -75.59 -37.73 59.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.121 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.497 ' HG2' ' HE2' ' C' ' 2' ' ' LYS . 36.5 mt-10 -132.55 88.31 2.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.731 179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.5 117.71 26.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.374 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -95.73 110.87 22.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.244 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.515 ' HB3' HD12 ' C' ' 47' ' ' ILE . 93.7 m-85 -94.66 115.58 27.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.895 0.379 . . . . 10.0 111.354 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -99.07 136.83 38.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.395 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 70.15 27.48 4.22 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 123.893 0.746 . . . . 10.0 111.703 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.515 HD12 ' HB3' ' C' ' 44' ' ' PHE . 78.4 mt -132.89 109.92 13.05 Favored Pre-proline 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.307 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.511 ' HG2' HG22 ' C' ' 51' ' ' VAL . 30.1 Cg_endo -64.89 152.22 83.01 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.912 2.408 . . . . 10.0 112.575 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 7.3 p -63.99 -34.44 78.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.727 -0.669 . . . . 10.0 111.946 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . 0.504 ' HE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -54.17 -57.7 10.15 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.511 HG22 ' HG2' ' C' ' 48' ' ' PRO . 35.8 m -64.77 -35.24 74.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.427 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.5 tp -63.98 -37.51 87.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.61 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 35.5 m -59.71 -40.67 88.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.584 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 50.5 tttp -68.49 -35.94 78.22 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.337 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.51 HG23 ' O ' ' C' ' 51' ' ' VAL . 78.4 t -62.97 -47.98 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.697 -0.483 . . . . 10.0 109.697 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.27 -40.95 92.19 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.553 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 61.6 mtm -65.55 -41.31 93.13 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 56.0 t80 -65.43 -40.83 93.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.603 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.419 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.8 m-85 -62.66 -46.65 87.23 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 35.6 m -58.4 -44.62 89.05 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.329 0.585 . . . . 10.0 110.146 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.457 ' CD1' ' HB3' ' B' ' 70' ' ' GLN . 34.4 t80 -64.85 -41.84 95.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.36 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -63.26 -38.71 92.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.247 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.419 HG23 ' O ' ' C' ' 59' ' ' PHE . 53.4 t -60.75 -47.54 92.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.765 -0.457 . . . . 10.0 109.765 178.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.8 mmt85 -71.65 -40.81 69.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.361 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.518 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 60.5 t80 -58.64 -47.58 83.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.981 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.59 32.39 0.79 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.968 0.413 . . . . 10.0 110.952 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -138.83 -56.01 0.61 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.649 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.04 -35.83 0.62 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.713 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.518 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 1.4 m -80.67 38.76 0.45 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.951 0.405 . . . . 10.0 111.892 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.01 -17.03 32.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.45 0.643 . . . . 10.0 109.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -78.46 -14.78 59.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.489 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.756 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 40.1 pt -99.46 166.85 12.15 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.377 -0.601 . . . . 10.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.756 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 44.7 Cg_endo -67.79 166.61 23.77 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.201 1.934 . . . . 10.0 113.247 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.565 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 7.9 tp10 -74.37 171.75 13.13 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.417 -0.957 . . . . 10.0 108.417 178.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.565 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 18.2 t80 -52.3 128.49 40.8 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 110.394 -0.224 . . . . 10.0 110.394 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 44.5 Cg_exo -57.01 129.55 35.09 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.811 2.34 . . . . 10.0 112.249 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.537 HG22 ' HA ' ' A' ' 16' ' ' LEU . 40.1 pt -84.05 40.36 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.307 0.575 . . . . 10.0 111.437 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.69 -57.3 0.36 Allowed Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.736 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -70.17 117.0 4.86 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.789 1.66 . . . . 10.0 110.778 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.519 ' HB2' ' HD2' ' A' ' 18' ' ' LYS . 3.3 pt-20 -73.98 3.73 6.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.987 0.736 . . . . 10.0 112.987 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 43.0 mm -83.07 82.11 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.398 0.618 . . . . 10.0 110.026 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.65 -37.36 0.12 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.428 -0.805 . . . . 10.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.513 ' HB3' ' HE2' ' A' ' 18' ' ' LYS . 20.1 tp -66.2 -25.42 66.92 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 22.4 mp0 -63.39 -32.93 74.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.715 -1.129 . . . . 10.0 109.508 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 8' ' ' LEU . 80.5 mt -78.42 -34.2 48.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.621 -0.718 . . . . 10.0 109.759 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 9' ' ' GLN . 6.2 tt -66.2 -27.86 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.067 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 46.8 ttp -59.21 -25.9 64.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.548 -0.751 . . . . 10.0 111.752 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.19 -29.23 70.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.993 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.96 -65.35 0.22 Allowed 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.472 0.916 . . . . 10.0 113.472 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -80.18 33.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.896 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 112.744 -0.142 . . . . 10.0 112.744 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -56.41 22.57 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 8' ' ' LEU . 2.0 tp -57.6 -34.84 69.68 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.63 0.604 . . . . 10.0 112.63 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.426 ' HA ' HD12 ' C' ' 86' ' ' LEU . 61.3 mt-30 -61.41 -37.19 82.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.045 0.45 . . . . 10.0 111.058 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -84.87 -41.95 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.52 -39.69 94.36 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.252 0.464 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -44.18 94.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.729 0.299 . . . . 10.0 111.011 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 tp -66.83 -30.53 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.237 0.542 . . . . 10.0 110.475 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.07 -3.24 57.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.744 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.19 -41.0 5.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.426 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' C' ' 82' ' ' ALA . 0.2 OUTLIER -161.61 133.14 5.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.834 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.0 mt -99.69 100.41 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HB3' HD22 ' C' ' 83' ' ' LEU . 23.5 ttpt -108.89 101.66 45.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 10.0 111.283 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.55 71.36 4.68 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.308 2.672 . . . . 10.0 110.717 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 mttm -128.22 177.92 6.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.064 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -83.89 144.57 29.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 10.0 111.093 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.13 105.21 18.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.733 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.011 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -112.13 140.12 23.19 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 108.461 -0.94 . . . . 10.0 108.461 179.23 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.754 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 57.8 Cg_exo -40.36 132.53 2.31 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 123.47 2.78 . . . . 10.0 112.772 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.729 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 17.8 Cg_endo -59.11 141.36 98.03 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.282 2.655 . . . . 10.0 112.876 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.413 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -80.05 135.15 55.17 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.251 179.071 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.44 -7.5 21.39 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 122.862 2.375 . . . . 10.0 112.812 -178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -38.89 80.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.394 -0.367 . . . . 10.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 30' ' ' ARG . 2.8 t -122.29 -117.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.23 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' H ' ' HB ' ' A' ' 29' ' ' VAL . 7.5 ptp180 -166.75 49.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.992 0.425 . . . . 10.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.417 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 14.4 tttm -148.52 150.61 33.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.778 -0.646 . . . . 10.0 109.803 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.729 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.0 pp -74.47 156.03 37.38 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.769 0.319 . . . . 10.0 111.002 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -98.91 170.64 8.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.62 -179.079 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -119.16 125.72 49.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.011 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 1.3 t70 -166.76 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.84 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -174.73 -67.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.825 -0.435 . . . . 10.0 109.825 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.672 -0.68 . . . . 10.0 110.293 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.863 0.363 . . . . 10.0 110.579 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -81.68 143.08 32.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.039 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -133.22 112.26 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.868 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -97.92 110.15 22.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.167 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.628 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.6 OUTLIER -122.18 153.71 38.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.937 0.399 . . . . 10.0 111.431 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.573 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 36.8 mtm -123.87 110.89 15.42 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.451 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.507 HD13 ' HB ' ' B' ' 75' ' ' VAL . 50.1 mm -81.61 113.23 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.32 110.31 21.44 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.434 0.635 . . . . 10.0 112.635 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.421 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 28.5 ttp85 -103.36 68.63 0.97 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 107.034 -1.469 . . . . 10.0 107.034 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.559 ' HB2' HG12 ' B' ' 90' ' ' ILE . 7.8 t-80 66.16 -88.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.909 -1.041 . . . . 10.0 111.144 -178.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -96.8 -21.77 17.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.844 0.354 . . . . 10.0 111.455 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 2.3 m -90.1 120.3 31.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.495 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.49 125.13 48.16 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.989 -0.374 . . . . 10.0 109.989 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.598 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 63.8 mt -118.63 118.37 57.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 120.715 0.293 . . . . 10.0 111.6 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -80.73 115.34 20.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.628 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -112.08 112.32 23.86 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.076 0.465 . . . . 10.0 112.248 -178.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.62 100.75 13.43 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.639 -1.245 . . . . 10.0 107.639 177.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -120.65 -173.44 2.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.879 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 mmtt -125.88 160.57 29.55 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.03 -25.44 66.91 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.055 0.455 . . . . 10.0 111.203 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -2.18 49.63 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 10.9 m -86.74 141.28 29.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.685 0.279 . . . . 10.0 110.87 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 16.0 p -87.91 159.58 18.3 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.544 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 t -63.31 -35.22 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.919 0.39 . . . . 10.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.91 -35.94 75.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.58 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.401 ' O ' HG13 ' B' ' 30' ' ' ILE . 38.6 mt-10 -63.95 -34.62 78.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.048 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.92 HD11 HD21 ' B' ' 57' ' ' LEU . 78.4 mt -63.73 -44.98 91.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.27 -34.26 77.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.125 179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -65.64 -39.44 91.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.146 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.401 HG13 ' O ' ' B' ' 26' ' ' GLU . 73.7 mt -66.2 -42.73 91.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.6 t -63.14 -37.91 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.445 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.64 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 1.0 OUTLIER -63.67 -33.67 76.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.499 179.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.84 -26.57 66.69 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.495 -0.86 . . . . 10.0 112.458 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 71.4 mt -91.37 -57.49 4.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 70.0 mt -83.45 -15.48 49.44 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.384 0.512 . . . . 10.0 112.384 -178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 83.8 mttt 64.16 31.72 13.07 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.234 -0.439 . . . . 10.0 112.147 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.452 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 7.6 mmt180 -112.91 132.18 22.44 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.142 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 125.85 10.54 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.695 2.93 . . . . 10.0 113.436 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.64 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 43.1 Cg_endo -68.23 -20.39 43.25 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.938 2.425 . . . . 10.0 112.102 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.33 -31.76 73.0 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.287 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -98.97 10.86 40.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.036 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -93.67 128.37 39.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.859 0.362 . . . . 10.0 110.825 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.403 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 70.0 mmt-85 -118.72 111.2 18.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.031 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 72.9 mt -93.28 121.14 34.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -114.78 122.12 45.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.13 0.49 . . . . 10.0 111.74 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.451 ' HG3' ' CZ ' ' B' ' 62' ' ' PHE . 4.5 tmtm? -118.19 123.52 45.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.401 -0.818 . . . . 10.0 108.833 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 57.4 43.19 23.57 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.443 0.465 . . . . 10.0 111.099 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 69.33 5.92 5.4 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.117 0.784 . . . . 10.0 113.117 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -119.19 147.03 44.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.736 0.303 . . . . 10.0 111.549 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.23 132.47 43.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.521 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 33.8 mt -78.41 171.07 15.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.088 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -83.22 -157.53 0.24 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.603 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.62 -50.65 0.46 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.097 0.475 . . . . 10.0 110.012 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.18 -21.53 54.69 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.842 -0.694 . . . . 10.0 112.845 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -73.97 157.41 36.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.949 0.404 . . . . 10.0 111.013 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.713 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 25.6 p -90.64 169.25 11.16 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.465 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.92 HD21 HD11 ' B' ' 27' ' ' LEU . 79.2 mt -62.07 -35.59 79.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.598 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.04 -22.95 65.44 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.387 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -94.75 -6.53 42.84 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.756 0.313 . . . . 10.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 44.5 m -107.84 23.05 15.06 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.046 0.387 . . . . 10.0 112.046 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.94 28.09 71.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.961 -0.638 . . . . 10.0 113.519 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.451 ' CZ ' ' HG3' ' B' ' 46' ' ' LYS . 45.0 m-85 -107.26 99.41 8.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.904 0.383 . . . . 10.0 110.757 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -124.31 178.05 5.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 6.1 m -75.59 4.97 6.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.502 . . . . 10.0 111.154 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -97.31 -38.15 9.77 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.46 -39.79 18.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.197 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -110.77 107.52 17.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.249 -0.887 . . . . 10.0 109.776 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.507 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 66.8 mtt180 -118.91 161.74 34.77 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.103 -178.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.507 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 10.7 Cg_endo -53.69 -34.73 75.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 123.163 2.576 . . . . 10.0 113.264 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.579 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.33 11.37 27.21 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.908 -0.317 . . . . 10.0 111.233 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -151.01 77.09 7.75 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.674 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.1 Cg_exo -76.24 132.2 13.6 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.748 2.299 . . . . 10.0 111.617 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.18 122.79 18.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.546 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -78.46 126.15 30.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.478 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.507 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.3 t -121.77 130.33 74.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.14 135.28 13.52 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.653 -0.784 . . . . 10.0 111.84 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.3 tp -116.36 104.12 11.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.915 0.388 . . . . 10.0 111.333 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.403 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -97.95 119.55 36.77 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 66.3 t80 -98.96 123.16 43.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.286 -0.264 . . . . 10.0 110.286 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -75.03 78.09 2.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.279 0.561 . . . . 10.0 110.754 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.502 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -85.96 136.03 33.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -67.88 128.47 36.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.988 -0.551 . . . . 10.0 112.2 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.27 19.27 9.97 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.677 -0.692 . . . . 10.0 112.398 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 3.1 m -111.86 112.81 24.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.829 0.347 . . . . 10.0 110.529 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -77.44 -8.51 57.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.752 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.448 ' O ' HG13 ' B' ' 90' ' ' ILE . 54.7 tt0 -60.95 -28.63 69.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.367 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.19 -40.96 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.211 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.94 -21.31 60.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.371 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 30.5 m -83.83 -23.83 31.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.407 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' B' ' 10' ' ' HIS . 29.2 mt -90.53 -33.79 6.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.427 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.19 113.53 11.7 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.686 ' HA ' ' O ' ' B' ' 95' ' ' SER . 57.2 Cg_endo -71.66 -2.67 11.73 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.899 2.4 . . . . 10.0 112.182 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -80.53 -45.72 16.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.353 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -88.64 -28.96 20.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.811 -0.632 . . . . 10.0 111.542 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.686 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 2.3 m -132.29 136.55 28.26 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.647 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.1 151.24 79.94 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 122.553 2.169 . . . . 10.0 111.539 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.35 127.03 24.2 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.985 2.457 . . . . 10.0 112.12 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.58 120.85 14.13 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.773 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.418 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.5 tp -135.69 132.48 19.63 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.341 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.546 ' HB2' ' HB2' ' B' ' 103' ' ' MET . 52.8 Cg_exo -58.22 127.7 25.87 Favored 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.635 2.223 . . . . 10.0 111.844 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.85 -36.47 83.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.958 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.424 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.3 m -73.15 -21.76 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.132 0.491 . . . . 10.0 111.104 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.546 ' HB2' ' HB2' ' B' ' 100' ' ' PRO . 74.7 mmm -111.42 62.18 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.65 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 83.7 tttt -131.27 -55.08 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 112.851 0.685 . . . . 10.0 112.851 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.1 Cg_exo -74.74 62.42 5.62 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.484 2.123 . . . . 10.0 111.793 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -130.98 -178.24 4.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.915 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.574 ' HB2' HE22 ' B' ' 118' ' ' GLN . 1.2 t0 -90.35 177.69 6.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.873 0.368 . . . . 10.0 111.82 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 12.7 m -107.36 132.73 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.675 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . 0.498 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -85.15 -150.59 13.05 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.984 -0.627 . . . . 10.0 113.133 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.02 -41.76 11.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.002 0.429 . . . . 10.0 111.295 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.5 m -79.91 166.12 21.97 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.684 -179.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -73.55 127.9 34.01 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 2.0 t30 74.97 13.96 3.26 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.613 0.571 . . . . 10.0 110.954 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.498 ' HG2' ' HA3' ' B' ' 109' ' ' GLY . 28.4 tt0 -85.84 121.61 28.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -106.4 146.06 30.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.081 0.467 . . . . 10.0 111.545 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.546 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -119.1 105.4 11.36 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.238 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.34 127.23 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.537 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . 0.574 HE22 ' HB2' ' B' ' 107' ' ' ASP . 21.0 mp0 . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.091 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.918 0.389 . . . . 10.0 110.729 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.661 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -109.12 119.07 38.42 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.056 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 16.7 mt -96.18 117.84 31.55 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 179.177 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mp -103.63 113.2 39.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.791 0.329 . . . . 10.0 110.222 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.8 p -83.26 176.24 9.3 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.875 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.1 m -72.04 -7.06 46.66 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -93.82 -2.38 53.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.045 0.45 . . . . 10.0 109.832 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.71 9.7 80.65 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 10.0 111.867 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.12 123.09 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.676 0.274 . . . . 10.0 110.627 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.661 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 14.4 mt-10 -94.87 114.48 26.35 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.686 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 94.7 m-85 -104.07 107.08 17.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.819 0.303 . . . . 10.0 111.819 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.598 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 10.8 mm -89.4 114.89 28.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.627 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 32.1 t -103.63 128.23 57.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.424 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -60.06 134.13 56.75 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.629 ' HA ' ' HB3' ' C' ' 18' ' ' ALA . 66.1 ttt180 -57.52 -28.81 63.81 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -55.51 -38.16 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.913 0.387 . . . . 10.0 111.139 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -95.09 -26.38 16.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.304 0.573 . . . . 10.0 110.148 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . 0.629 ' HB3' ' HA ' ' C' ' 15' ' ' ARG . . . -64.26 -33.51 75.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.632 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 75.2 mt -58.39 -51.5 69.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.229 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.548 ' O ' HG13 ' C' ' 24' ' ' ILE . 24.0 m -65.47 -41.26 93.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.432 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 24.3 m -58.39 -41.68 85.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.857 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.32 -15.36 81.21 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.982 -0.628 . . . . 10.0 112.575 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 38.7 m -82.13 -31.86 30.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.008 0.432 . . . . 10.0 110.166 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . 0.548 HG13 ' O ' ' C' ' 20' ' ' THR . 22.1 mt -69.87 158.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.205 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -71.4 87.03 0.85 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.078 0.466 . . . . 10.0 110.988 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -107.24 166.01 10.95 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.167 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 97.0 mmm -79.03 42.91 0.49 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.937 0.347 . . . . 10.0 111.937 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.34 -18.18 60.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.221 0.534 . . . . 10.0 110.427 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 15.9 m -101.05 14.59 31.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.751 -0.659 . . . . 10.0 109.85 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.97 -61.18 5.42 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.105 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.48 161.06 21.68 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.28 1.987 . . . . 10.0 111.968 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.71 23.82 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.943 -0.571 . . . . 10.0 112.621 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -127.27 113.56 16.46 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.939 0.4 . . . . 10.0 111.398 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -91.27 94.42 9.53 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -89.8 172.28 9.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -63.5 -14.93 55.94 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.593 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -55.78 22.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.775 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.414 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.6 tp10 -67.24 -31.64 72.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.591 -0.731 . . . . 10.0 110.939 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -62.57 -24.26 67.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.034 0.445 . . . . 10.0 111.034 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.37 -53.43 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.278 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -128.09 105.26 8.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.841 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.414 HG22 ' O ' ' C' ' 38' ' ' GLU . 4.1 t -84.22 121.59 36.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.796 0.331 . . . . 10.0 110.737 -179.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -90.39 103.82 16.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.71 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -98.19 112.88 24.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.182 0.515 . . . . 10.0 111.533 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -106.12 144.21 33.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.314 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 67.69 22.1 9.08 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.752 0.657 . . . . 10.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.2 mt -128.36 107.97 19.34 Favored Pre-proline 0 C--O 1.237 0.396 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.664 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -63.46 148.14 92.81 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.966 2.444 . . . . 10.0 111.837 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.1 p -59.76 -39.62 85.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.511 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . 0.464 ' CE1' ' HG2' ' B' ' 100' ' ' PRO . 0.2 OUTLIER -53.57 -58.56 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 113.006 0.743 . . . . 10.0 113.006 -179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.408 ' O ' HG23 ' C' ' 55' ' ' VAL . 28.3 m -62.71 -36.67 76.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 10.0 111.324 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 27.0 tp -64.09 -36.06 82.78 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.691 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 19.9 m -63.0 -40.6 98.26 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.292 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -66.79 -37.27 84.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.395 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.408 HG23 ' O ' ' C' ' 51' ' ' VAL . 89.6 t -62.26 -47.26 93.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.779 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.2 m -61.24 -39.2 89.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.838 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.0 mtm -65.01 -42.24 94.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.045 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -67.11 -39.79 86.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.573 -0.285 . . . . 10.0 110.416 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.512 ' O ' HG23 ' C' ' 63' ' ' VAL . 1.4 m-85 -60.89 -48.81 80.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.163 -0.472 . . . . 10.0 109.899 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 25.7 m -59.16 -40.92 87.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.214 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.579 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 27.8 t80 -64.01 -43.08 96.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.455 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -66.61 -34.22 77.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.426 . . . . 10.0 111.166 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.512 HG23 ' O ' ' C' ' 59' ' ' PHE . 54.1 t -62.17 -46.4 96.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 N-CA-C 109.934 -0.395 . . . . 10.0 109.934 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -74.57 -38.05 62.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.804 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 12.8 t80 -58.59 -52.17 66.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.677 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -83.76 42.01 0.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.218 0.532 . . . . 10.0 110.539 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -152.77 -62.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.583 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.62 -36.02 1.45 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.333 -0.394 . . . . 10.0 111.909 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 20.4 m -82.5 43.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 111.932 -179.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 -5.01 48.91 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.603 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -92.0 -7.8 47.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.029 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 43.4 pt -102.38 161.9 21.89 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.467 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -65.67 164.48 26.44 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.749 2.3 . . . . 10.0 112.534 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.4 168.25 11.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.273 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -51.19 131.32 32.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 122.314 0.246 . . . . 10.0 110.971 179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.5 124.45 15.18 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.131 2.554 . . . . 10.0 112.313 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 16' ' ' LEU . 15.3 pt -83.64 45.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 10.0 111.231 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.624 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.22 -53.91 0.19 Allowed Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.844 -0.616 . . . . 10.0 111.956 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.624 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 14.8 Cg_exo -69.72 98.87 0.71 Allowed 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.062 1.841 . . . . 10.0 110.725 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 18' ' ' LYS . 44.3 mt-10 -68.69 3.61 1.81 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.042 0.756 . . . . 10.0 113.042 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . 0.488 ' HA ' ' OE1' ' C' ' 84' ' ' GLU . 20.2 mm -77.66 -2.94 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.522 0.677 . . . . 10.0 110.625 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -68.5 -28.94 67.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.622 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 18' ' ' LYS . 8.8 tp -77.51 -22.58 50.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.861 0.362 . . . . 10.0 110.846 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.488 ' OE1' ' HA ' ' C' ' 81' ' ' ILE . 9.1 mp0 -64.79 -26.14 68.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 10.0 109.651 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 mt -75.91 -27.31 57.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.571 -0.74 . . . . 10.0 109.703 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 9' ' ' GLN . 0.5 OUTLIER -68.65 -20.99 64.48 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.437 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.6 -23.62 67.46 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.915 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . 0.661 ' HB1' ' HD2' ' C' ' 91' ' ' PHE . . . -57.98 -44.35 87.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.347 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.82 -58.57 0.39 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -78.59 19.64 0.48 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.999 0.37 . . . . 10.0 111.999 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.661 ' HD2' ' HB1' ' C' ' 88' ' ' ALA . 81.1 m-85 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.98 -0.533 . . . . 10.0 109.638 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.489 ' HA3' ' SD ' ' C' ' 27' ' ' MET . . . . . . . . 0 N--CA 1.479 1.544 0 N-CA-C 111.801 -0.52 . . . . 10.0 111.801 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.575 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.1 OUTLIER -57.82 -59.72 4.8 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.651 0.612 . . . . 10.0 112.651 -179.229 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.693 HD21 ' HB3' ' C' ' 85' ' ' LEU . 24.5 tp -65.66 -37.38 86.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.461 -178.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -58.25 -24.5 59.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.146 0.498 . . . . 10.0 111.101 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -98.85 -46.78 5.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.104 0.478 . . . . 10.0 110.496 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.579 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 97.1 mt -63.43 -34.83 78.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.06 92.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.727 0.299 . . . . 10.0 111.324 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.3 tp -68.14 -28.85 67.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.522 . . . . 10.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.56 -10.29 59.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.283 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.3 -36.04 10.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.21 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.605 ' HA ' HG22 ' C' ' 77' ' ' ILE . 5.2 tp -151.1 121.72 7.46 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.265 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 mp -86.63 92.62 3.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.68 -0.859 . . . . 10.0 108.68 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' C' ' 83' ' ' LEU . 81.1 tttt -106.28 105.9 55.54 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.006 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -98.0 64.68 0.09 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.386 2.724 . . . . 10.0 110.802 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -124.8 170.84 10.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.018 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -77.44 145.49 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.989 -0.551 . . . . 10.0 111.529 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.881 HD11 HD23 ' C' ' 83' ' ' LEU . 44.2 mm -116.28 99.61 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.219 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.833 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 40.9 tttp -104.92 142.05 23.84 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 107.662 -1.236 . . . . 10.0 107.662 178.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -36.1 130.92 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 123.586 2.858 . . . . 10.0 112.912 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.805 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 10.6 Cg_endo -52.93 137.66 61.37 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.568 2.845 . . . . 10.0 113.165 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.61 125.08 83.31 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.252 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.95 -15.58 48.56 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.08 2.52 . . . . 10.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.19 -35.08 79.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.464 -0.335 . . . . 10.0 111.181 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.1 t -130.0 -127.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.35 -0.386 . . . . 10.0 109.996 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.506 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 4.9 ptp180 -155.22 52.29 0.61 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.136 0.493 . . . . 10.0 111.02 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -149.17 151.36 34.2 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.805 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -74.74 148.47 40.43 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.124 -0.324 . . . . 10.0 110.124 178.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.527 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -84.92 155.17 21.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.369 -179.466 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -107.59 110.82 22.8 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.833 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 21.7 t70 -162.43 -77.79 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.55 -69.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.731 -1.128 . . . . 10.0 109.397 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mmm . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 120.758 0.313 . . . . 10.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -80.3 141.16 35.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.119 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.417 HG11 HD13 ' B' ' 57' ' ' LEU . 79.6 t -117.06 116.08 50.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.096 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.67 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 56.4 m-85 -104.08 114.75 29.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.346 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.562 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 1.1 pt? -134.27 158.33 44.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.878 0.37 . . . . 10.0 111.445 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.585 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 60.8 mtm -125.94 117.03 22.44 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.418 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 44.4 mm -87.49 112.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.155 -0.683 . . . . 10.0 109.155 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -108.92 109.3 20.34 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.937 0.717 . . . . 10.0 112.937 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -99.81 73.77 1.8 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.388 -1.338 . . . . 10.0 107.388 177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.604 ' HB2' HG12 ' B' ' 90' ' ' ILE . 6.9 t-160 66.63 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.362 -0.835 . . . . 10.0 111.18 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -108.91 -24.55 11.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.947 0.404 . . . . 10.0 110.905 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.476 ' HA ' ' HB2' ' C' ' 10' ' ' GLU . 2.4 m -86.06 107.77 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.89 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 1.7 m -110.66 123.47 50.07 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.423 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.794 HG12 HD12 ' C' ' 12' ' ' ILE . 20.5 mt -118.72 122.19 68.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.758 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . 0.512 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 52.6 t80 -79.84 121.68 25.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 178.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.562 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 2.2 m -112.11 118.36 35.17 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 10.0 111.607 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.874 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 7.0 t70 -104.09 93.58 4.93 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.155 -1.054 . . . . 10.0 108.155 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.2 -167.95 1.36 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.479 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -127.58 166.37 18.16 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -62.61 -23.12 66.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.892 0.377 . . . . 10.0 111.6 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.98 -9.58 59.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 10.0 111.716 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 3.7 m -81.19 142.81 32.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 10.0 110.69 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 57.7 p -92.21 169.6 10.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.617 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 77.4 t -69.7 -34.9 63.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.089 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -63.57 -35.05 79.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.349 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -62.17 -36.14 80.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.764 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.671 HD11 HD21 ' B' ' 57' ' ' LEU . 84.6 mt -60.87 -45.36 94.86 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -60.46 -40.03 89.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.053 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -62.66 -41.08 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.572 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -66.79 -47.8 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.271 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -61.6 -36.53 73.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 10.0 110.53 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.721 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 0.2 OUTLIER -60.51 -36.41 78.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.029 179.451 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.98 -5.88 89.37 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 121.063 -0.589 . . . . 10.0 112.791 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 69.4 mt -107.48 -50.2 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.792 0.33 . . . . 10.0 110.81 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 30.5 mt -87.14 -9.58 54.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 10.0 111.767 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.03 50.15 12.58 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.503 0.502 . . . . 10.0 111.474 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.58 142.25 31.11 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.512 -179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.85 128.83 16.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.498 2.799 . . . . 10.0 113.102 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.721 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 60.0 Cg_endo -71.86 -24.94 20.56 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 123.027 2.485 . . . . 10.0 112.743 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 39.9 t0 -68.99 -23.05 64.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.933 0.397 . . . . 10.0 111.038 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -90.7 -2.99 57.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.592 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -88.85 135.8 33.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.955 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.518 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 60.3 mmt-85 -125.46 110.81 14.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.217 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 90.4 mt -91.79 120.79 32.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.881 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -114.36 118.69 34.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.081 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.471 ' HD2' ' CZ ' ' B' ' 62' ' ' PHE . 47.4 tttm -123.06 130.56 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.901 -0.777 . . . . 10.0 108.901 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 61.23 33.76 19.02 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.068 0.461 . . . . 10.0 110.242 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 65.55 21.89 11.76 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.454 -0.794 . . . . 10.0 111.477 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -130.78 149.15 52.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.781 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.471 HD11 ' HD2' ' B' ' 43' ' ' ARG . 48.1 tp -78.13 131.42 37.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.733 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -80.15 150.76 30.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.504 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.71 124.37 39.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.817 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.22 -33.6 65.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.004 0.742 . . . . 10.0 113.004 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.41 -22.49 67.4 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.821 -0.704 . . . . 10.0 113.81 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.11 157.77 23.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.245 0.545 . . . . 10.0 111.796 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.737 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 26.3 p -94.19 167.49 11.52 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.467 178.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.671 HD21 HD11 ' B' ' 27' ' ' LEU . 43.9 mt -59.08 -43.16 91.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.764 0.316 . . . . 10.0 111.724 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.52 -35.44 72.79 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.952 -0.642 . . . . 10.0 113.061 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -79.4 -17.83 53.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.809 0.337 . . . . 10.0 111.298 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 64.3 m -90.47 6.57 42.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.649 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.22 16.64 53.12 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.565 -0.826 . . . . 10.0 112.716 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' B' ' 46' ' ' LYS . 44.3 m-85 -92.04 90.31 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.837 0.351 . . . . 10.0 110.145 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 39.4 p -116.02 176.83 4.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' B' ' 68' ' ' ARG . 0.7 OUTLIER -69.99 -0.13 6.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 10.0 111.592 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -95.0 -51.14 4.79 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.861 0.362 . . . . 10.0 110.241 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.99 -25.46 43.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.931 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.67 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -119.25 95.88 4.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.135 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' B' ' 64' ' ' SER . 26.9 mtm180 -119.0 156.79 51.85 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.767 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.401 ' HB2' ' HA ' ' C' ' 61' ' ' TYR . 31.9 Cg_endo -65.32 -15.14 48.61 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.419 2.079 . . . . 10.0 111.228 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.45 ' HG3' ' HB3' ' B' ' 68' ' ' ARG . 0.0 OUTLIER -101.39 -7.48 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.605 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.647 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -160.84 92.08 1.56 Allowed Pre-proline 0 C--O 1.235 0.297 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.675 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.585 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 5.7 Cg_exo -80.56 130.28 7.79 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.904 2.403 . . . . 10.0 111.376 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.55 127.29 30.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.626 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m -85.78 127.18 34.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.056 0.455 . . . . 10.0 111.617 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 39.2 t -121.74 133.24 68.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.382 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.04 137.64 17.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.775 -0.726 . . . . 10.0 111.577 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 tp -116.89 109.63 17.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.071 0.463 . . . . 10.0 111.887 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -98.69 151.7 20.44 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -128.37 123.37 33.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.746 0.307 . . . . 10.0 110.808 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -74.64 89.18 2.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.177 0.513 . . . . 10.0 111.191 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -119.78 129.87 54.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.588 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.04 137.62 49.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.038 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 69.5 13.21 8.33 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.596 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.6 m -116.92 96.21 5.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.621 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.23 -8.83 57.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.708 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.459 ' O ' HG13 ' B' ' 90' ' ' ILE . 33.4 tt0 -60.11 -31.56 70.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.451 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.32 88.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.161 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 38.7 mt -68.43 -21.6 64.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 16.2 m -84.04 -18.14 38.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.344 . . . . 10.0 111.111 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.604 HG12 ' HB2' ' B' ' 10' ' ' HIS . 43.4 mt -91.48 -29.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.856 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.58 116.06 23.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.217 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.452 ' HA ' ' O ' ' B' ' 95' ' ' SER . 24.0 Cg_exo -65.79 -14.36 44.24 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.004 2.469 . . . . 10.0 111.953 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -91.86 -15.61 27.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.433 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 10.9 m -103.17 -30.94 10.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.885 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 69.2 m -148.68 147.1 23.74 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.6 138.78 50.88 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.311 2.008 . . . . 10.0 111.282 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.92 125.42 8.25 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.217 2.611 . . . . 10.0 111.75 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -56.09 113.46 1.54 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.634 -0.712 . . . . 10.0 111.873 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 23.2 tp -143.87 125.41 8.16 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.419 -0.809 . . . . 10.0 109.279 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 24.9 Cg_exo -64.83 123.72 12.07 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.8 2.333 . . . . 10.0 111.997 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -63.21 -30.28 71.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.176 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 17.4 m -66.77 -14.01 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.297 0.57 . . . . 10.0 110.116 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 78.4 mmm -123.08 34.8 5.03 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.606 ' H ' ' HD2' ' B' ' 105' ' ' PRO . 30.3 tttm -105.6 -49.1 0.12 Allowed Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 113.029 0.752 . . . . 10.0 113.029 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.606 ' HD2' ' H ' ' B' ' 104' ' ' LYS . 70.1 Cg_endo -73.67 63.02 4.71 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 122.0 1.8 . . . . 10.0 112.688 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.531 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 39.1 mt-30 -133.6 150.31 51.61 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.092 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.74 148.98 45.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.584 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.8 m -76.17 141.52 41.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.979 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -84.88 -144.15 6.66 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.52 -37.04 12.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.119 0.485 . . . . 10.0 110.658 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.647 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 66.4 m -80.65 161.94 24.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.671 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.83 126.68 28.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.016 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 66.06 14.71 9.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.817 -0.629 . . . . 10.0 112.064 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 31.3 tt0 -76.43 136.2 39.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.799 0.333 . . . . 10.0 110.176 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -115.37 144.41 43.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.812 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -130.33 113.15 14.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.007 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.531 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.6 t -76.39 126.33 36.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.44 -0.346 . . . . 10.0 110.392 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.474 -0.33 . . . . 10.0 111.534 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.065 0.46 . . . . 10.0 111.321 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.559 ' HD2' ' HB3' ' C' ' 10' ' ' GLU . 36.9 ttpt -118.07 115.93 25.84 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.766 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 26.6 mt -87.8 124.33 33.51 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.774 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' C' ' 43' ' ' ASN . 15.4 mt -107.61 113.07 42.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -83.82 166.26 18.1 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.653 -0.249 . . . . 10.0 111.019 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -68.69 -10.52 56.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.4 . . . . 10.0 111.493 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -84.48 -11.84 55.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.157 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.98 28.46 20.83 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.147 -0.781 . . . . 10.0 111.147 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -106.46 133.09 51.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.171 -0.307 . . . . 10.0 110.171 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.559 ' HB3' ' HD2' ' C' ' 2' ' ' LYS . 25.2 mt-10 -98.2 129.82 44.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.354 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -123.23 101.12 7.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.68 0.276 . . . . 10.0 110.634 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.794 HD12 HG12 ' B' ' 14' ' ' ILE . 45.3 mt -94.06 125.62 46.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 4.5 t -107.64 148.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.689 -0.232 . . . . 10.0 110.904 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.874 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 58.2 tttt -59.56 138.18 57.78 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.119 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -51.56 -43.73 62.49 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.277 0.473 . . . . 10.0 112.277 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.569 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 36.5 tt0 -56.84 -52.17 66.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.396 . . . . 10.0 111.51 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -65.79 -41.29 92.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.775 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.87 96.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.398 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 65.7 mt -62.6 -48.24 80.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.71 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 8.7 m -60.74 -41.16 94.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 36.4 m -67.59 -31.72 71.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.429 . . . . 10.0 110.561 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.79 -9.84 83.2 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.932 -0.651 . . . . 10.0 112.151 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -84.03 -17.97 38.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.055 0.455 . . . . 10.0 110.109 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 10.8 mt -80.3 157.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.674 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -73.34 78.1 1.36 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.201 0.524 . . . . 10.0 110.524 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.575 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -94.58 170.75 9.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.458 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.489 ' SD ' ' HA3' ' A' ' 6' ' ' GLY . 92.2 mmm -78.34 31.41 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.249 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mp -68.59 -26.12 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.158 0.504 . . . . 10.0 110.503 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 7.6 m -95.71 15.73 19.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.199 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.0 -61.31 3.8 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.52 -0.764 . . . . 10.0 112.378 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.82 166.61 15.6 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.713 2.275 . . . . 10.0 111.464 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.03 -66.64 2.71 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.31 -0.471 . . . . 10.0 113.551 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -126.05 120.9 31.45 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 122.39 -0.476 . . . . 10.0 111.415 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -95.65 90.96 5.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.35 166.6 22.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.702 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -63.8 -33.97 76.86 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -63.53 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.759 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.461 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.1 mp0 -72.69 -24.0 60.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.432 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -80.3 -19.26 47.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.26 0.552 . . . . 10.0 109.929 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -94.09 -59.95 1.85 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.979 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -105.83 89.18 3.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.087 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.461 HG22 ' O ' ' C' ' 38' ' ' GLU . 2.4 t -84.89 94.66 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.109 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . 0.403 ' HA ' ' HB ' ' C' ' 4' ' ' ILE . 21.0 t-20 -82.18 119.12 23.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.049 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -104.56 124.16 48.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.545 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -105.08 140.5 38.16 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.934 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 69.52 19.78 7.37 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.878 0.736 . . . . 10.0 111.011 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -127.04 107.5 21.92 Favored Pre-proline 0 C--O 1.236 0.389 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.98 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.506 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 27.5 Cg_exo -64.97 158.75 49.82 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 123.269 2.646 . . . . 10.0 112.13 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -67.37 -41.52 84.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.266 -179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -57.41 8.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.518 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.509 ' HB ' HD21 ' C' ' 85' ' ' LEU . 32.4 m -65.56 -35.25 74.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.674 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 29.7 tp -66.66 -34.69 78.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 24.5 m -60.16 -42.92 95.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.73 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 46.8 tttp -65.9 -35.18 79.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.458 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.441 HG23 ' O ' ' C' ' 51' ' ' VAL . 66.8 t -65.41 -44.57 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.125 -0.489 . . . . 10.0 109.736 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 54.8 m -61.18 -42.65 98.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.687 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 71.4 mtm -66.63 -38.91 87.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.726 179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.579 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 82.9 t80 -62.09 -43.84 97.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.587 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.421 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.3 m-85 -65.13 -43.35 92.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.262 179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 75.3 m -57.85 -43.78 86.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.415 0.626 . . . . 10.0 109.584 179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' B' ' 70' ' ' GLN . 14.0 t80 -67.07 -42.8 84.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.497 -0.774 . . . . 10.0 110.133 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -59.97 -39.12 84.53 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.232 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.421 HG23 ' O ' ' C' ' 59' ' ' PHE . 56.0 t -59.4 -50.08 81.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.004 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' C' ' 64' ' ' ARG . 11.1 mmt180 -71.96 -37.24 69.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.653 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.611 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 83.3 t80 -59.03 -42.36 90.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.965 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.6 13.65 15.36 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.758 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -117.2 -56.34 2.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.331 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.12 -20.44 0.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.611 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 13.7 m -84.15 27.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.127 0.489 . . . . 10.0 111.512 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 -11.2 59.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.278 0.561 . . . . 10.0 110.128 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -77.42 -22.63 51.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.326 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.744 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 37.0 pt -100.37 165.88 13.63 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.031 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.744 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 58.6 Cg_endo -71.11 171.2 16.38 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.306 2.004 . . . . 10.0 113.241 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.64 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 5.9 tp10 -71.51 173.68 7.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.147 -0.933 . . . . 10.0 108.904 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.64 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 17.5 t80 -54.01 130.26 58.27 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 73.1 Cg_exo -51.71 131.79 38.95 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.135 2.557 . . . . 10.0 112.914 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.605 HG22 ' HA ' ' A' ' 16' ' ' LEU . 16.7 pt -84.14 37.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.915 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.439 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -90.18 -54.58 0.29 Allowed Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.906 -0.588 . . . . 10.0 112.55 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.439 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 34.6 Cg_endo -65.49 116.94 4.19 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.758 1.639 . . . . 10.0 111.681 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -69.58 -2.39 11.36 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.44 94.9 4.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.221 0.534 . . . . 10.0 110.452 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.502 ' HB3' HD23 ' A' ' 16' ' ' LEU . . . -161.51 -42.46 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.578 -0.737 . . . . 10.0 109.619 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.881 HD23 HD11 ' A' ' 22' ' ' ILE . 8.4 tp -68.43 -24.85 64.78 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.687 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 26.9 mp0 -63.27 -35.64 81.01 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.887 -1.051 . . . . 10.0 108.946 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.693 ' HB3' HD21 ' A' ' 8' ' ' LEU . 44.1 mt -78.97 -34.36 44.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.264 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.421 HD13 HD12 ' C' ' 83' ' ' LEU . 5.4 tt -64.46 -30.23 71.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.221 -0.9 . . . . 10.0 110.034 179.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 29.0 ttp -62.53 -18.16 61.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.601 -0.727 . . . . 10.0 111.44 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.56 83.06 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.636 -0.256 . . . . 10.0 110.593 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.94 -51.67 0.53 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.453 0.908 . . . . 10.0 113.453 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -78.81 13.54 1.66 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.878 0.371 . . . . 10.0 111.49 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.876 0 CA-C-O 118.786 -0.626 . . . . 10.0 109.435 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 CA-C-O 120.196 -0.224 . . . . 10.0 112.916 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.58 ' HB3' ' HA ' ' C' ' 26' ' ' ALA . 0.0 OUTLIER -60.18 -67.37 0.4 Allowed 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.871 0.323 . . . . 10.0 111.871 -179.374 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.631 HD23 ' HB3' ' C' ' 85' ' ' LEU . 9.4 mp -63.87 -34.79 78.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 10.0 110.392 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -52.45 -34.97 51.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.694 -0.685 . . . . 10.0 111.185 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -100.32 -40.77 7.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.566 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.505 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 79.7 mt -64.18 -39.86 94.88 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.064 0.765 . . . . 10.0 113.064 -178.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.31 -30.64 69.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.628 0.252 . . . . 10.0 111.382 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.4 -32.58 73.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.151 0.5 . . . . 10.0 110.192 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.65 56.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.749 -0.659 . . . . 10.0 110.553 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.04 -26.63 15.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.761 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.9 OUTLIER -164.93 118.99 1.29 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.644 179.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.3 mt -86.02 97.03 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 178.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.544 ' HE3' ' HD2' ' A' ' 20' ' ' LYS . 76.8 tttt -113.29 97.01 41.65 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.186 -178.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -88.22 59.14 2.88 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.854 2.369 . . . . 10.0 111.631 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.544 ' HD2' ' HE3' ' A' ' 18' ' ' LYS . 34.3 mttm -111.66 177.31 4.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.786 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -81.06 151.97 28.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.719 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.413 HD11 ' CD2' ' C' ' 83' ' ' LEU . 44.9 mm -116.05 110.79 32.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.143 0.497 . . . . 10.0 111.351 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.2 OUTLIER -126.87 137.38 30.43 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.642 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 18.1 Cg_exo -32.7 137.1 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 124.27 3.313 . . . . 10.0 114.297 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.763 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 18.4 Cg_endo -58.87 131.13 40.17 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.056 2.504 . . . . 10.0 112.217 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' H ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -71.72 123.21 89.08 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.643 179.772 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 -9.2 21.76 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.995 2.463 . . . . 10.0 111.876 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -31.63 72.93 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.103 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 ' HG2' ' A' ' 30' ' ' ARG . 14.0 t -134.78 -100.06 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.609 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.1 ptp180 176.81 53.66 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.191 0.597 . . . . 10.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 tttm -149.52 149.19 30.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.45 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.763 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -72.4 159.6 33.72 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.931 0.396 . . . . 10.0 110.861 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -108.83 179.47 4.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.874 -179.202 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.424 ' H ' HG22 ' A' ' 33' ' ' THR . 41.5 mt-10 -124.6 130.2 51.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.84 0.352 . . . . 10.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 0.7 OUTLIER -168.37 -74.08 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.632 179.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.439 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -175.07 -56.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.851 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.621 -0.704 . . . . 10.0 110.261 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.7 tmm? . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 120.976 0.417 . . . . 10.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.0 143.29 31.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.346 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -127.49 118.31 49.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 120.992 0.425 . . . . 10.0 110.264 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.526 ' HD2' ' HZ ' ' B' ' 15' ' ' PHE . 62.4 m-85 -105.37 113.09 26.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.45 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.541 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.9 OUTLIER -128.38 156.99 42.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.809 0.338 . . . . 10.0 111.354 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.498 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 64.6 mtm -125.21 108.37 11.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.529 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.504 HD13 ' HB ' ' B' ' 75' ' ' VAL . 48.4 mm -81.33 104.34 9.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.419 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -100.49 102.04 13.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.631 0.604 . . . . 10.0 112.631 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.522 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 29.7 ttp85 -89.25 65.8 7.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.535 ' HB2' HG12 ' B' ' 90' ' ' ILE . 9.1 t-160 68.73 -77.94 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.145 -0.934 . . . . 10.0 110.645 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -108.54 -15.81 14.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.986 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 1.3 m -97.56 99.35 10.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.243 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -98.17 113.68 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.738 0.304 . . . . 10.0 110.561 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 51.5 mt -108.36 119.2 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.447 -0.342 . . . . 10.0 110.909 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . 0.526 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 76.1 t80 -80.66 124.24 28.84 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.815 -0.439 . . . . 10.0 109.815 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.541 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.2 m -117.93 122.28 42.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.041 0.448 . . . . 10.0 112.093 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.861 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 4.7 t70 -104.47 99.25 8.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.818 -1.178 . . . . 10.0 107.818 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.55 -167.89 1.6 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.844 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -123.45 160.39 27.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -61.22 -26.72 67.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.956 0.408 . . . . 10.0 111.954 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.89 -10.75 59.81 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.983 -0.553 . . . . 10.0 112.062 -179.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' B' ' 57' ' ' LEU . 17.8 m -72.86 143.16 47.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.167 -0.308 . . . . 10.0 110.167 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 10.7 p -90.37 157.91 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.722 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 53.9 t -60.72 -36.75 73.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 10.0 111.165 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.9 -30.59 70.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.833 179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.18 -36.76 85.22 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.27 179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.51 HD11 HD21 ' B' ' 57' ' ' LEU . 78.3 mt -61.23 -43.08 99.46 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.534 -0.543 . . . . 10.0 109.534 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -61.71 -38.52 88.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.168 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 61.9 mtp180 -65.87 -39.49 90.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.818 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 99.0 mt -65.96 -46.31 88.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.946 -0.57 . . . . 10.0 109.58 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 70.0 t -62.15 -38.1 80.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.024 -0.535 . . . . 10.0 109.753 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.816 ' HG3' ' HD3' ' B' ' 39' ' ' PRO . 2.2 tm-20 -61.54 -37.1 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.08 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.02 -4.35 77.53 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 120.972 -0.633 . . . . 10.0 112.895 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 84.4 mt -112.68 -54.03 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.725 0.298 . . . . 10.0 111.23 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 49.9 mt -82.39 -14.66 54.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.239 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 63.4 mttt 58.0 48.68 12.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.757 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -137.27 139.98 29.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.328 -0.851 . . . . 10.0 110.072 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -43.85 123.87 4.24 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.923 3.082 . . . . 10.0 113.665 -179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . 0.816 ' HD3' ' HG3' ' B' ' 32' ' ' GLU . 57.5 Cg_endo -71.4 -16.53 31.0 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.924 2.416 . . . . 10.0 111.848 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.69 -38.48 85.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.216 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.468 ' HA ' ' NH2' ' B' ' 43' ' ' ARG . 7.8 mm-40 -96.61 14.18 25.69 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.378 0.51 . . . . 10.0 112.378 -178.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.89 127.02 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.489 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 26.1 mmt-85 -112.95 108.23 17.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.567 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 79.3 mt -90.71 112.37 24.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.087 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' B' ' 93' ' ' PHE . 35.1 m-85 -108.06 117.38 34.0 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.546 ' HB3' HD21 ' B' ' 51' ' ' LEU . 43.7 tttm -132.23 138.33 47.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.301 -1.0 . . . . 10.0 108.301 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 63.39 27.98 15.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.446 0.466 . . . . 10.0 109.871 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 67.12 17.24 10.38 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.464 -0.789 . . . . 10.0 111.613 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -129.49 166.11 20.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.664 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.9 tp -89.91 130.54 36.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.577 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' B' ' 46' ' ' LYS . 82.9 mt -72.71 158.2 36.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.226 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.493 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 18.0 t0 -100.54 127.15 46.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.956 -179.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -66.24 -28.2 68.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.597 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.1 8.18 79.94 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.109 -178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 97.5 mttt -116.79 159.71 21.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.865 0.364 . . . . 10.0 110.817 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 28.2 p -92.06 170.47 9.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.613 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.536 ' O ' ' HB2' ' B' ' 62' ' ' PHE . 26.3 mt -62.72 -42.45 99.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.79 -33.8 69.06 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.165 -0.54 . . . . 10.0 112.589 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -80.03 -13.64 59.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.678 0.275 . . . . 10.0 111.572 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 59.9 m -99.62 16.27 23.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.949 0.404 . . . . 10.0 111.633 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.17 11.85 77.62 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.728 -0.748 . . . . 10.0 113.199 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' B' ' 57' ' ' LEU . 29.9 m-85 -86.84 96.86 10.35 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 117.061 0.431 . . . . 10.0 110.186 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 156.83 31.89 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 50.7 m -60.86 -22.28 64.1 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.183 0.438 . . . . 10.0 112.183 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -76.43 -37.36 57.14 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.812 0.301 . . . . 10.0 111.812 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -39.32 18.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.196 0.522 . . . . 10.0 109.674 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.56 82.1 1.99 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.283 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -89.67 157.76 46.22 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.029 -178.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.28 -21.24 71.17 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.609 2.206 . . . . 10.0 111.819 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' CG ' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -108.67 4.05 23.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.794 179.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.569 ' HB1' ' H ' ' B' ' 112' ' ' ALA . . . -155.83 80.23 4.05 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.613 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.498 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 7.7 Cg_exo -74.7 144.83 31.92 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.889 2.392 . . . . 10.0 111.99 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.8 120.74 19.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.816 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.46 120.93 21.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.465 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.504 ' HB ' HD13 ' B' ' 7' ' ' ILE . 42.0 t -118.77 133.84 64.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.19 137.64 14.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.69 -0.767 . . . . 10.0 111.626 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.81 107.93 14.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.969 0.414 . . . . 10.0 111.578 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.489 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -103.55 138.83 39.7 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.183 -0.673 . . . . 10.0 109.183 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -114.79 121.75 44.25 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -74.57 82.87 2.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 10.0 111.849 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.21 122.32 43.97 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 178.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -66.01 145.88 55.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.338 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.93 24.79 14.74 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.875 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 2.3 m -132.09 112.34 12.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.207 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -69.82 -19.1 63.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.052 0.453 . . . . 10.0 111.198 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.44 ' O ' HG13 ' B' ' 90' ' ' ILE . 29.8 tt0 -54.64 -33.2 60.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.217 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.55 -30.26 69.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.769 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 14.0 mt -92.18 -9.92 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.316 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 43.0 m -87.23 -35.62 18.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.917 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.535 HG12 ' HB2' ' B' ' 10' ' ' HIS . 3.6 mt -89.54 14.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.234 0.54 . . . . 10.0 110.825 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.94 103.85 46.41 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.548 ' HA ' ' O ' ' B' ' 95' ' ' SER . 18.8 Cg_exo -67.97 -3.86 11.36 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.338 2.692 . . . . 10.0 112.054 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.422 ' HB2' ' CE1' ' B' ' 45' ' ' TYR . 39.5 t80 -75.65 -27.62 58.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.998 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 68.7 m -124.31 -35.56 2.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.239 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.548 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 58.8 m -103.42 151.54 38.65 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.419 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.49 157.84 32.56 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.553 2.169 . . . . 10.0 111.441 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 132.87 31.43 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.268 1.979 . . . . 10.0 111.4 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -68.67 108.97 3.58 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.069 0.462 . . . . 10.0 111.424 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 19.2 tp -138.57 125.43 13.05 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.35 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.3 Cg_exo -60.75 135.01 57.25 Favored 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 122.81 2.34 . . . . 10.0 112.698 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -61.34 -38.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.971 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 m -68.24 -18.2 23.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 10.0 111.236 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.455 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 93.8 mmm -115.45 51.03 0.95 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.468 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.567 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 60.7 tttm -119.38 -53.87 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.152 0.797 . . . . 10.0 113.152 -179.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.567 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.8 Cg_exo -76.77 67.62 7.32 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.499 2.133 . . . . 10.0 111.903 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.577 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 56.0 mt-30 -133.4 162.15 32.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.517 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.499 ' HB3' ' HB3' ' B' ' 116' ' ' ALA . 2.8 t0 -79.91 178.03 8.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.021 0.438 . . . . 10.0 111.356 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.88 131.13 43.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.25 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -83.68 -153.37 15.46 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.95 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.36 -29.77 17.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.098 0.475 . . . . 10.0 110.739 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 19.4 m -93.74 159.68 15.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.83 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . 0.569 ' H ' ' HB1' ' B' ' 71' ' ' ALA . . . -69.85 134.22 48.24 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.347 -0.982 . . . . 10.0 108.347 178.303 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.03 -5.96 2.08 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.566 0.541 . . . . 10.0 111.46 -179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 36.1 tt0 -74.16 127.34 32.7 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.845 0.355 . . . . 10.0 110.466 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -109.69 139.8 44.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . 0.499 ' HB3' ' HB3' ' B' ' 107' ' ' ASP . . . -99.62 101.93 13.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.361 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.577 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.2 t -70.5 109.24 2.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.101 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.445 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.699 0.285 . . . . 10.0 110.985 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -101.68 105.43 16.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.816 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.641 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 36.5 mt -91.1 113.44 25.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.808 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 33.3 mt -100.6 119.4 48.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -93.09 166.24 12.44 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.659 -0.246 . . . . 10.0 110.673 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -16.97 44.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -85.67 -3.77 58.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.799 0.333 . . . . 10.0 110.729 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.59 18.28 60.45 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.584 -0.817 . . . . 10.0 112.713 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 135.9 33.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -104.65 113.23 26.67 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.999 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.641 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 97.4 m-85 -102.87 113.02 26.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.692 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 22.3 mm -98.82 117.91 44.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -103.83 137.97 30.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.544 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.861 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 74.5 tttt -60.02 134.44 57.05 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -51.69 -43.6 62.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.854 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -51.89 -51.61 55.6 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.96 0.41 . . . . 10.0 111.744 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -74.22 -37.28 63.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.332 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.63 95.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 10.0 111.479 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.74 -49.6 77.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.815 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.407 ' HB ' HG22 ' C' ' 63' ' ' VAL . 3.1 m -63.15 -36.61 84.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.981 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.2 m -67.16 -33.14 74.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 10.0 110.407 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.1 -11.69 84.65 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.885 -0.598 . . . . 10.0 112.398 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 -18.26 47.86 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 10.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -83.75 160.53 3.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.394 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -73.74 86.43 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.136 0.493 . . . . 10.0 111.059 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -99.24 173.44 6.79 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.829 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.724 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 90.0 mmm -78.58 31.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.873 0.323 . . . . 10.0 111.873 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 tp -65.25 -31.99 73.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.568 . . . . 10.0 109.809 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.5 14.19 19.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.466 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.6 -60.29 5.51 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.865 -0.607 . . . . 10.0 113.185 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.91 179.76 2.56 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.345 2.03 . . . . 10.0 112.461 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.21 -55.44 18.7 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.289 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -142.13 121.29 12.99 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.784 -0.245 . . . . 10.0 110.824 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -96.91 91.24 5.54 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.6 159.83 26.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.047 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -60.58 -25.37 66.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.497 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.2 -35.1 71.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.073 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.05 -28.77 64.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.388 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.02 -16.11 60.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.029 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -85.12 -52.38 5.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.385 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -129.56 99.06 5.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.465 -0.789 . . . . 10.0 109.376 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 3.6 t -83.52 114.72 24.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.628 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -90.33 109.11 20.23 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.869 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -106.76 94.47 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 10.0 111.374 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' C' ' 46' ' ' GLU . 86.8 mtt180 -89.89 156.71 18.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 179.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' C' ' 45' ' ' ARG . 12.2 mm-40 70.95 16.6 6.47 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.234 0.54 . . . . 10.0 111.305 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 75.8 mt -130.15 117.94 18.19 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.457 -0.792 . . . . 10.0 109.708 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.574 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 24.6 Cg_exo -65.55 138.83 56.13 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.791 2.327 . . . . 10.0 111.806 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -59.95 -40.85 90.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.146 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -50.04 61.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.902 -0.59 . . . . 10.0 112.392 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 26.0 m -73.87 -27.4 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 120.942 -0.303 . . . . 10.0 111.593 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.86 -39.36 93.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.512 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -35.34 72.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.86 0.362 . . . . 10.0 110.791 179.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.14 -35.11 77.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.116 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 47.0 t -67.24 -47.44 81.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.478 -0.564 . . . . 10.0 109.478 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 35.9 m -59.56 -40.53 87.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.462 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 68.5 mtm -65.69 -42.51 91.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.849 179.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.505 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 71.6 t80 -65.44 -40.58 93.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.817 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.404 ' O ' HG23 ' C' ' 63' ' ' VAL . 3.3 m-30 -61.7 -47.34 85.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 10.0 109.925 179.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.5 m -60.58 -42.21 96.23 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.972 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.438 ' CG ' ' HB3' ' B' ' 70' ' ' GLN . 21.2 t80 -62.86 -42.53 99.79 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.325 179.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -64.13 -37.54 87.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.167 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.407 HG22 ' HB ' ' C' ' 20' ' ' THR . 54.2 t -61.82 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.006 0.431 . . . . 10.0 110.089 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' C' ' 64' ' ' ARG . 10.2 mmt180 -72.79 -42.31 64.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.185 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.494 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 88.7 t80 -57.25 -48.44 78.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.3 50.06 1.7 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.208 0.528 . . . . 10.0 110.771 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -162.16 -58.44 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.297 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -130.1 -36.92 1.5 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.981 0.42 . . . . 10.0 111.647 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.494 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 11.2 m -83.9 37.22 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.68 8.09 23.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.5 0.667 . . . . 10.0 109.694 179.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -99.52 -2.34 36.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.523 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.71 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 42.1 pt -115.91 166.54 12.09 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.71 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 73.4 Cg_endo -75.57 172.36 16.47 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.371 2.047 . . . . 10.0 112.718 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.56 170.32 9.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 10.0 110.036 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 57.2 t80 -53.94 130.63 57.96 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.766 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 52.8 Cg_exo -54.07 118.62 5.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.994 2.463 . . . . 10.0 112.197 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' ' 16' ' ' LEU . 22.9 pt -81.18 42.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.657 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -89.32 -59.47 0.25 Allowed Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 58.0 Cg_endo -72.09 111.16 3.11 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.707 1.604 . . . . 10.0 111.365 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.549 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.52 56.37 2.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.681 -178.84 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 3.9 mm -120.08 9.8 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.465 0.65 . . . . 10.0 110.549 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -88.28 -26.03 22.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.095 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.472 ' CB ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 tp -70.87 -27.58 63.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.069 0.461 . . . . 10.0 109.816 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.471 ' HA ' HD23 ' A' ' 32' ' ' LEU . 15.0 mp0 -61.39 -31.65 71.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.668 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.631 ' HB3' HD23 ' A' ' 8' ' ' LEU . 27.5 mt -77.5 -35.99 53.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.349 178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.2 -23.81 65.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.579 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . 0.443 ' SD ' ' HD3' ' A' ' 25' ' ' PRO . 38.6 ttp -57.49 -26.95 62.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.27 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.59 -30.85 71.64 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.57 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 68.87 -65.54 0.28 Allowed 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -82.9 36.56 0.5 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.352 0.501 . . . . 10.0 112.352 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.724 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 12.2 m-85 . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.128 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.685 -0.166 . . . . 10.0 112.685 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -63.74 1.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -179.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' C' ' 85' ' ' LEU . 11.1 tp -62.74 -27.93 69.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.609 -0.269 . . . . 10.0 111.501 -179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.546 ' HA ' ' HG ' ' C' ' 86' ' ' LEU . 5.7 mt-30 -58.98 -26.86 64.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.349 0.595 . . . . 10.0 110.765 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -105.01 -38.73 6.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.199 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.515 ' HB3' ' CE2' ' C' ' 58' ' ' TYR . 85.8 mt -62.86 -38.8 92.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.406 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.33 84.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.682 0.277 . . . . 10.0 110.802 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 tp -67.49 -27.73 67.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.366 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.02 -17.98 44.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.157 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.8 -48.83 6.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.784 -0.643 . . . . 10.0 110.603 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HA ' HG22 ' C' ' 77' ' ' ILE . 1.4 tp -149.8 124.63 9.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.407 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -95.73 93.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.112 -0.699 . . . . 10.0 109.112 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' CD ' ' HB2' ' C' ' 80' ' ' GLU . 28.1 ttpt -98.01 116.75 65.61 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.226 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -90.83 38.18 0.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.951 2.434 . . . . 10.0 111.972 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.421 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 57.2 mttm -94.95 166.58 11.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.237 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -79.03 154.84 29.15 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.597 HD11 HD23 ' C' ' 83' ' ' LEU . 47.3 mm -118.41 105.93 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.06 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.918 ' HD2' ' HB3' ' A' ' 35' ' ' ASP . 39.5 tttp -122.75 143.46 40.25 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 23' ' ' LYS . 33.0 Cg_exo -29.6 130.07 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 124.557 3.505 . . . . 10.0 114.326 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.712 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 19.5 Cg_endo -58.34 135.4 67.73 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 123.393 2.729 . . . . 10.0 113.026 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -74.66 128.33 85.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.839 179.794 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -68.95 -13.62 37.02 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.099 2.533 . . . . 10.0 112.986 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.06 -35.67 80.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.974 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.2 t -129.78 -122.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.995 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' CZ ' ' HB3' ' C' ' 48' ' ' PRO . 5.4 ptp180 -160.2 58.09 0.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.19 0.519 . . . . 10.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.43 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 18.8 tttm -152.31 154.56 35.92 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.682 -0.69 . . . . 10.0 109.256 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.712 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.2 pp -77.69 152.78 33.57 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.744 0.306 . . . . 10.0 110.536 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.552 ' HB ' ' HD3' ' A' ' 23' ' ' LYS . 2.5 m -87.34 149.22 24.65 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.231 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -105.11 99.71 9.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.851 0.358 . . . . 10.0 110.285 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.918 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 3.6 t70 -149.78 -74.76 0.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.148 -0.478 . . . . 10.0 109.959 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HE ' ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER 179.69 -68.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.878 -0.786 . . . . 10.0 108.878 179.002 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.3 m0 . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.153 -0.927 . . . . 10.0 109.255 179.342 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.412 ' HA ' ' OE2' ' B' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.051 0.453 . . . . 10.0 110.334 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.51 132.36 35.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.707 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . 0.419 HG11 HD13 ' B' ' 57' ' ' LEU . 57.5 t -121.4 116.57 50.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.707 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.562 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 52.8 m-85 -107.35 113.24 26.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.737 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.759 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.7 OUTLIER -128.01 158.4 38.0 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.866 0.365 . . . . 10.0 111.323 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.614 ' HG3' ' HB2' ' B' ' 72' ' ' PRO . 57.3 mtm -128.51 109.25 11.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.642 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.479 HD13 ' HB ' ' B' ' 75' ' ' VAL . 40.9 mm -83.51 110.14 17.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -107.86 108.1 19.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -91.69 71.48 5.8 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.593 -1.262 . . . . 10.0 107.593 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.574 ' HB2' HG12 ' B' ' 90' ' ' ILE . 8.5 t-160 67.19 -77.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.482 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' B' ' 10' ' ' HIS . 73.3 mmtt -110.27 -7.61 14.82 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -106.36 104.49 14.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.519 0.2 . . . . 10.0 111.394 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.5 m -101.04 118.08 36.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.783 0.325 . . . . 10.0 110.568 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.525 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 53.8 mt -110.86 123.85 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.743 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . 0.529 ' HZ ' ' HD2' ' B' ' 4' ' ' PHE . 86.6 t80 -81.08 125.17 29.87 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.731 -0.47 . . . . 10.0 109.731 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.759 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.6 m -118.07 119.2 34.03 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.161 0.505 . . . . 10.0 111.6 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -104.91 101.55 11.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.318 -0.993 . . . . 10.0 108.318 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.72 -171.2 2.32 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.89 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -124.35 162.41 23.86 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.412 ' OE2' ' HA ' ' B' ' 1' ' ' MET . 56.2 mt-10 -61.11 -22.94 65.13 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.345 0.498 . . . . 10.0 112.345 -179.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -2.07 47.04 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -91.88 144.54 25.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.531 0.205 . . . . 10.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 32.3 p -93.31 167.31 11.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.078 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.593 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 75.5 t -66.3 -34.54 70.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.865 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -62.14 -36.37 81.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 10.0 110.357 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.66 -33.2 75.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.835 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.958 HD11 HD21 ' B' ' 57' ' ' LEU . 69.7 mt -63.39 -45.95 88.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 10.0 109.928 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.52 -32.54 73.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.658 -0.701 . . . . 10.0 110.529 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -64.79 -37.46 87.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.037 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -69.01 -44.48 81.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.44 -33.64 57.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.482 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.544 ' O ' ' HA ' ' B' ' 36' ' ' LYS . 29.7 tt0 -59.8 -34.22 72.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.96 -0.563 . . . . 10.0 111.058 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.7 -19.29 58.39 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.542 -0.837 . . . . 10.0 112.844 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 80.7 mt -89.24 -57.91 3.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 10.0 111.66 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 39.8 mt -91.86 -8.12 47.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.854 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' B' ' 32' ' ' GLU . 85.1 mttt 58.78 51.2 7.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.368 0.604 . . . . 10.0 110.817 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' B' ' 79' ' ' PHE . 25.5 mmt180 -125.02 133.65 25.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.052 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.37 125.57 19.25 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 122.928 2.418 . . . . 10.0 112.294 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.69 -21.84 73.04 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.225 2.616 . . . . 10.0 113.059 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -64.39 -33.23 75.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.1 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.412 ' HB2' ' CE1' ' B' ' 79' ' ' PHE . 12.7 mm-40 -94.14 -2.77 52.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.059 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -82.64 126.85 32.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.54 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 86.7 mmt-85 -120.02 110.86 17.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' B' ' 51' ' ' LEU . 54.0 mt -92.86 118.08 30.73 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.905 0.383 . . . . 10.0 111.062 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -112.98 117.57 32.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.724 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.504 ' HB3' HD21 ' B' ' 51' ' ' LEU . 14.4 tmtt? -128.99 137.69 51.5 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.317 -0.994 . . . . 10.0 108.317 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 66.28 27.25 10.21 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.514 0.509 . . . . 10.0 109.749 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 67.89 17.07 9.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.773 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -132.12 169.79 15.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 41.7 tp -85.24 135.07 34.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.955 0.407 . . . . 10.0 111.202 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' B' ' 46' ' ' LYS . 65.2 mt -79.0 150.23 32.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.532 179.325 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HB3' ' HB2' ' B' ' 55' ' ' LYS . 14.7 t0 -92.19 113.64 25.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.0 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.593 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 1.4 m-20 -58.02 -28.01 64.08 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.651 0.611 . . . . 10.0 112.651 -179.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.64 -11.62 68.16 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.707 -0.759 . . . . 10.0 113.425 -178.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.476 ' HB2' ' HB3' ' B' ' 52' ' ' ASP . 59.4 mttp -95.29 153.74 17.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.968 0.413 . . . . 10.0 110.796 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.688 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 32.6 p -83.37 165.54 19.18 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.23 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.958 HD21 HD11 ' B' ' 27' ' ' LEU . 74.4 mt -58.35 -44.73 88.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.473 -0.33 . . . . 10.0 111.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -57.16 -33.07 64.04 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.451 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.57 -29.57 52.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.946 0.403 . . . . 10.0 111.086 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . 0.494 ' HB2' ' HD2' ' B' ' 62' ' ' PHE . 36.9 m -83.58 14.37 3.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 111.696 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 81.66 12.35 81.72 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 121.081 -0.581 . . . . 10.0 112.905 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.494 ' HD2' ' HB2' ' B' ' 60' ' ' CYS . 61.3 m-85 -87.79 85.7 7.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.003 0.43 . . . . 10.0 110.321 179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 47.1 p -114.42 165.23 12.95 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.435 -0.58 . . . . 10.0 109.435 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 9.7 m -65.54 -5.15 7.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.897 0.379 . . . . 10.0 111.971 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -81.8 -46.35 14.31 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.233 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.31 -35.14 18.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.937 179.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.562 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -101.35 93.31 5.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.275 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -109.43 157.84 36.23 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.666 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.61 -17.17 58.7 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.402 2.068 . . . . 10.0 111.518 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.13 -5.76 21.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.507 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' B' ' 111' ' ' SER . . . -157.54 89.48 2.44 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.723 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.614 ' HB2' ' HG3' ' B' ' 6' ' ' MET . 4.6 Cg_exo -79.14 138.29 14.19 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.966 2.444 . . . . 10.0 111.941 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.67 117.45 8.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.533 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -80.1 125.59 30.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.086 0.47 . . . . 10.0 111.672 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.479 ' HB ' HD13 ' B' ' 7' ' ' ILE . 32.0 t -119.3 139.27 47.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.456 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -88.18 131.25 10.54 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.582 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.439 ' HB2' ' CG2' ' B' ' 7' ' ' ILE . 52.0 tp -109.64 99.36 8.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.873 0.368 . . . . 10.0 111.321 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.452 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -92.51 113.42 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' B' ' 37' ' ' ARG . 80.3 t80 -96.05 117.35 30.5 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.64 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -71.87 91.57 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.224 0.535 . . . . 10.0 111.221 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' B' ' 84' ' ' THR . . . -99.64 129.96 45.83 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.19 129.88 41.7 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.38 19.86 11.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.312 -0.858 . . . . 10.0 112.624 179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' B' ' 81' ' ' ALA . 2.0 m -117.08 112.96 21.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.853 0.359 . . . . 10.0 110.127 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -74.09 -6.37 47.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.127 0.788 . . . . 10.0 113.127 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.471 ' O ' HG13 ' B' ' 90' ' ' ILE . 25.4 tt0 -62.91 -32.6 73.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.935 0.398 . . . . 10.0 111.341 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.95 -37.45 74.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.89 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.25 -15.27 61.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.928 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.92 -26.06 17.77 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.574 HG12 ' HB2' ' B' ' 10' ' ' HIS . 7.7 mt -84.11 -11.82 11.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 10.0 110.982 -179.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -85.67 113.36 50.74 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.847 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.563 ' HA ' ' O ' ' B' ' 95' ' ' SER . 23.4 Cg_exo -66.68 -14.94 45.91 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.047 2.498 . . . . 10.0 111.827 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -74.0 -37.38 64.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.262 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.4 p -96.67 -44.86 6.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.817 0.341 . . . . 10.0 111.021 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 15.9 m -111.45 138.98 21.57 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.121 -0.491 . . . . 10.0 110.657 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.04 153.75 76.77 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.386 2.057 . . . . 10.0 111.519 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -52.51 126.85 22.07 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.036 2.491 . . . . 10.0 112.575 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -70.31 107.29 3.69 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.259 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 24.0 tp -138.77 126.74 13.64 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.91 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 31.9 Cg_exo -60.13 127.01 21.74 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.589 2.193 . . . . 10.0 111.778 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.66 -31.26 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.735 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 20.7 m -67.5 -14.67 18.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.683 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.5 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 79.9 mmm -114.51 10.69 16.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.129 0.49 . . . . 10.0 109.873 179.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 25.4 ttpt -78.27 -53.42 1.35 Allowed Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 112.834 0.679 . . . . 10.0 112.834 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 2.9 Cg_exo -76.93 71.43 6.2 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.474 2.116 . . . . 10.0 112.356 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.529 ' HG2' ' HA ' ' B' ' 117' ' ' VAL . 53.6 mt-30 -135.73 167.73 20.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.0 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.62 159.3 19.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.944 0.402 . . . . 10.0 111.735 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.5 m -82.82 138.22 34.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' HG2' ' B' ' 114' ' ' GLU . . . -93.64 -174.7 39.97 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 121.085 -0.578 . . . . 10.0 112.312 179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.27 -33.18 67.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.992 0.425 . . . . 10.0 111.546 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.653 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 1.0 OUTLIER -85.25 159.55 20.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.166 -179.363 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.56 121.73 15.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.332 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.28 13.53 6.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.921 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.571 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.2 tt0 -73.36 128.66 36.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -106.4 130.42 54.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.799 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -113.97 107.81 16.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.352 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.529 ' HA ' ' HG2' ' B' ' 106' ' ' GLN . 2.4 t -72.05 126.7 33.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.085 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.3 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.022 0.439 . . . . 10.0 110.775 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.596 ' HD3' ' HG2' ' C' ' 41' ' ' GLU . 85.0 tttt -110.57 119.0 37.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.742 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.468 HD22 ' HE2' ' C' ' 44' ' ' PHE . 43.2 mt -99.92 129.83 46.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.058 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 37.4 mt -113.5 119.91 62.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.7 p -89.64 168.36 12.2 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.178 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -69.15 -16.57 63.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.825 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -81.05 -16.71 52.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.94 0.4 . . . . 10.0 110.542 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 98.7 13.25 41.32 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.409 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -90.82 130.37 36.79 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.821 -0.436 . . . . 10.0 109.821 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -98.7 134.3 41.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.106 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -124.31 123.25 39.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.675 0.274 . . . . 10.0 111.29 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.525 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 33.2 mm -102.14 114.56 41.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 t -97.63 141.43 15.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.414 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -61.8 121.97 14.2 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.42 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 37.5 ttt-85 -51.36 -39.91 58.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.764 0.653 . . . . 10.0 112.764 -178.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -58.37 -52.37 65.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.809 0.337 . . . . 10.0 110.948 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -68.46 -33.01 73.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.091 0.472 . . . . 10.0 110.49 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.82 88.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.773 -0.648 . . . . 10.0 110.688 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 85.2 mt -61.67 -45.28 94.7 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.883 -0.414 . . . . 10.0 109.883 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.45 -38.64 91.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.975 178.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -65.53 -36.78 84.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.286 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.72 -8.49 81.77 Favored Glycine 0 C--N 1.33 0.209 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.334 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 18.7 m -81.36 -20.96 39.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.393 0.616 . . . . 10.0 109.578 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 6.7 mt -84.06 159.03 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.175 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -76.11 81.19 2.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.143 0.497 . . . . 10.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.28 -163.19 0.85 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.876 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . . . . . . . . . 83.9 mmm -101.76 27.39 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.64 -0.254 . . . . 10.0 111.453 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.91 -36.45 84.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.265 0.555 . . . . 10.0 110.495 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.2 m -91.58 14.32 15.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.397 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -57.75 4.94 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-N 115.823 -0.626 . . . . 10.0 113.16 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.44 -160.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.686 2.258 . . . . 10.0 111.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.37 -110.64 0.16 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.78 -0.724 . . . . 10.0 112.285 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -86.69 123.97 32.44 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 122.753 -0.263 . . . . 10.0 110.612 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -101.25 74.99 1.6 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.005 0.431 . . . . 10.0 110.105 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.15 158.44 33.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.335 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.03 -27.77 63.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.969 0.359 . . . . 10.0 111.969 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.03 -35.82 77.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.02 0.438 . . . . 10.0 109.931 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -84.87 -21.7 29.66 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.74 -0.663 . . . . 10.0 109.824 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 2.1 m -77.72 -40.11 42.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.517 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -68.0 -47.31 68.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.862 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.596 ' HG2' ' HD3' ' C' ' 2' ' ' LYS . 37.1 mt-10 -124.82 90.43 3.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.18 115.63 21.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.364 -0.38 . . . . 10.0 110.886 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -91.98 111.96 23.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.917 0.389 . . . . 10.0 110.804 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.468 ' HE2' HD22 ' C' ' 3' ' ' LEU . 70.8 m-85 -97.36 114.85 26.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.112 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' C' ' 45' ' ' ARG . 39.3 mtt180 -100.11 147.13 26.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.221 -0.445 . . . . 10.0 109.887 178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 65.52 21.41 11.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.749 0.655 . . . . 10.0 110.839 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . . . . . . . . . 90.0 mt -129.59 109.49 17.42 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-O 121.079 0.466 . . . . 10.0 111.131 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 38.1 Cg_exo -63.77 150.98 87.17 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.135 2.557 . . . . 10.0 112.13 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 16.2 p -64.99 -38.96 92.67 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.411 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -54.24 46.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.78 -0.645 . . . . 10.0 112.294 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . 0.443 ' O ' HG23 ' C' ' 55' ' ' VAL . 30.3 m -67.81 -34.62 68.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.638 -0.255 . . . . 10.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.53 -37.93 89.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.62 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . 0.433 ' O ' ' HG3' ' C' ' 57' ' ' MET . 40.8 m -58.05 -40.71 81.62 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.543 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -67.55 -35.59 79.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.567 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' C' ' 51' ' ' VAL . 59.4 t -64.26 -46.49 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.847 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 57.4 m -60.66 -39.49 88.58 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.158 -0.473 . . . . 10.0 110.628 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' C' ' 53' ' ' SER . 52.6 mtm -67.29 -41.45 85.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.334 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.515 ' CE2' ' HB3' ' A' ' 11' ' ' LEU . 90.6 t80 -62.11 -42.87 99.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.224 -0.443 . . . . 10.0 110.49 179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.423 ' O ' HG23 ' C' ' 63' ' ' VAL . 5.4 m-85 -61.49 -47.2 86.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.266 179.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 26.2 m -61.06 -42.45 98.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.161 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.18 -44.82 90.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.078 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 tptt -59.93 -42.14 93.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.612 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' C' ' 67' ' ' ASN . 51.3 t -59.12 -50.94 77.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.313 179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' C' ' 64' ' ' ARG . 9.5 mmt85 -66.9 -42.33 85.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.733 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.8 -43.75 85.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.231 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.09 15.88 14.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.115 0.484 . . . . 10.0 111.18 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' C' ' 63' ' ' VAL . 5.8 t30 -111.93 -59.24 2.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.173 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.43 -30.14 0.56 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.389 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 10.4 m -80.82 47.58 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.941 0.4 . . . . 10.0 111.59 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.56 4.61 53.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.602 0.715 . . . . 10.0 110.018 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -80.83 -26.03 37.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.05 -0.977 . . . . 10.0 109.656 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . 0.653 ' HB ' ' HD2' ' C' ' 73' ' ' PRO . 29.4 pt -96.15 167.28 12.69 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.787 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' C' ' 72' ' ' ILE . 97.9 Cg_endo -80.34 179.88 5.78 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.276 1.984 . . . . 10.0 112.574 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' C' ' 75' ' ' PHE . 9.6 tp10 -69.65 168.64 14.42 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.651 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.433 ' N ' ' HG3' ' C' ' 74' ' ' GLU . 31.4 t80 -48.23 127.57 12.41 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 122.382 0.273 . . . . 10.0 111.624 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -48.46 128.15 17.26 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.657 2.905 . . . . 10.0 113.614 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.481 HG22 ' HA ' ' A' ' 16' ' ' LEU . 13.2 pt -83.08 50.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.383 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.514 ' H ' ' HD2' ' C' ' 79' ' ' PRO . . . -100.2 -57.59 0.13 Allowed Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 112.145 0.424 . . . . 10.0 112.145 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.514 ' HD2' ' H ' ' C' ' 78' ' ' ALA . 54.7 Cg_endo -69.9 120.13 6.95 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.605 1.537 . . . . 10.0 111.098 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.425 ' HB2' ' CD ' ' A' ' 18' ' ' LYS . 4.5 pt-20 -71.44 -8.18 52.2 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mm -79.54 83.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.491 0.662 . . . . 10.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 -41.98 0.16 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.15 -0.932 . . . . 10.0 108.867 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.597 HD23 HD11 ' A' ' 22' ' ' ILE . 11.8 tp -68.1 -25.57 65.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.506 -0.77 . . . . 10.0 108.981 178.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 20.9 mp0 -61.17 -36.14 79.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.168 -0.924 . . . . 10.0 109.64 178.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.623 ' HB3' HD21 ' A' ' 8' ' ' LEU . 38.5 mt -74.56 -33.57 62.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.838 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 9' ' ' GLN . 5.0 tt -66.77 -28.37 68.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.171 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 28.0 ttp -60.48 -20.98 61.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.672 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.02 -30.56 71.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.449 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 70.14 -61.68 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.912 0.708 . . . . 10.0 112.912 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.4 41.74 0.63 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.251 0.548 . . . . 10.0 111.369 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.823 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.194 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.406 -0.278 . . . . 10.0 112.406 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' C' ' 25' ' ' LYS . 0.0 OUTLIER -63.07 -61.26 2.5 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.068 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.772 HD21 ' HB3' ' C' ' 85' ' ' LEU . 27.0 tp -62.89 -28.76 70.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.231 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -55.99 -29.7 60.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.489 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -104.89 -34.63 7.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.979 0.418 . . . . 10.0 110.661 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.618 ' HB3' ' HE2' ' C' ' 58' ' ' TYR . 84.8 mt -63.99 -40.82 97.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 10.0 112.0 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' C' ' 86' ' ' LEU . . . -67.49 -29.22 68.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.773 0.321 . . . . 10.0 111.058 -179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 tp -66.04 -34.88 79.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.332 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.74 -13.44 56.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.543 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.34 -42.11 13.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.239 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.946 ' HA ' HG22 ' C' ' 77' ' ' ILE . 0.4 OUTLIER -158.95 116.77 2.84 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.24 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.485 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 22.5 mt -85.58 88.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.708 -0.849 . . . . 10.0 108.708 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.547 ' HB3' ' HB2' ' C' ' 83' ' ' LEU . 82.5 tttt -97.62 103.7 17.64 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.737 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.485 ' HD3' ' O ' ' A' ' 17' ' ' ILE . 33.5 Cg_endo -91.57 72.73 0.8 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 123.248 2.632 . . . . 10.0 111.452 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -131.68 169.71 15.79 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.497 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -85.09 149.04 25.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.697 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mm -102.02 129.53 53.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.202 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 1.012 ' HG3' ' HB3' ' A' ' 35' ' ' ASP . 0.0 OUTLIER -134.04 145.16 54.55 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.228 -1.027 . . . . 10.0 108.228 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.661 ' HD2' ' HD3' ' A' ' 23' ' ' LYS . 45.7 Cg_exo -36.14 131.05 0.36 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.693 2.928 . . . . 10.0 112.678 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.887 ' HA ' ' HA ' ' A' ' 32' ' ' LEU . 12.9 Cg_endo -54.89 152.64 28.22 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 123.401 2.734 . . . . 10.0 113.233 -178.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 mt -74.44 117.99 66.4 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.837 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.15 -23.54 52.8 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.726 2.284 . . . . 10.0 112.287 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.26 61.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.63 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.3 t -108.07 -132.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.27 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HD3' ' HB3' ' C' ' 48' ' ' PRO . 6.2 ptp180 -158.49 56.29 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 10.0 110.525 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.421 ' HG2' ' N ' ' A' ' 32' ' ' LEU . 16.9 tttm -152.09 149.75 29.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.334 -0.848 . . . . 10.0 108.876 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.887 ' HA ' ' HA ' ' A' ' 25' ' ' PRO . 4.3 pp -73.07 154.52 40.39 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.715 0.293 . . . . 10.0 111.108 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 23' ' ' LYS . 1.6 m -93.29 165.7 12.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.162 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -113.62 127.74 56.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.592 0.234 . . . . 10.0 110.629 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 1.012 ' HB3' ' HG3' ' A' ' 23' ' ' LYS . 3.5 t70 -172.19 -79.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.795 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.84 -54.44 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 . . . . . 0 C--O 1.247 0.961 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.081 179.944 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmm? . . . . . 0 N--CA 1.483 1.218 0 CA-C-O 120.572 0.225 . . . . 10.0 111.482 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.15 115.5 1.1 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.204 -0.295 . . . . 10.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.75 122.11 63.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.272 0.558 . . . . 10.0 111.318 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.517 ' H ' ' HB1' ' B' ' 67' ' ' ALA . 47.4 m-85 -108.13 105.25 14.9 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.469 -0.787 . . . . 10.0 109.629 179.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.845 ' HG ' ' HB ' ' B' ' 16' ' ' THR . 0.4 OUTLIER -113.31 150.4 32.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.031 0.443 . . . . 10.0 111.499 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' MET . . . . . 0.539 ' HB2' ' HB2' ' B' ' 72' ' ' PRO . 38.5 ttm -120.91 101.36 7.64 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.47 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.65 HD13 ' HB ' ' B' ' 75' ' ' VAL . 47.5 mm -80.94 113.56 20.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -111.63 101.87 10.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.524 ' HB3' ' HB ' ' B' ' 12' ' ' THR . 21.8 ttp85 -89.75 73.63 7.56 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.568 -1.271 . . . . 10.0 107.568 177.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.75 ' HB2' HG12 ' B' ' 90' ' ' ILE . 12.7 t-80 65.09 -81.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.434 -0.803 . . . . 10.0 111.529 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -114.76 0.37 13.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.787 0.327 . . . . 10.0 111.603 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.524 ' HB ' ' HB3' ' B' ' 9' ' ' ARG . 4.7 m -106.72 100.03 9.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.158 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 50.2 m -93.89 127.51 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.866 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.616 ' HA ' ' HB ' ' C' ' 12' ' ' ILE . 55.5 mt -123.35 117.34 51.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.305 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -82.69 119.01 23.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.681 -0.489 . . . . 10.0 109.681 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' THR . . . . . 0.845 ' HB ' ' HG ' ' B' ' 5' ' ' LEU . 1.7 m -113.65 113.01 24.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.203 0.525 . . . . 10.0 112.16 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.979 ' HB3' ' HD2' ' C' ' 14' ' ' LYS . 6.4 t70 -99.26 99.79 10.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.581 -1.266 . . . . 10.0 107.581 178.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.8 -166.18 1.56 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.517 -0.311 . . . . 10.0 111.288 -178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -128.03 158.21 38.56 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.842 -0.429 . . . . 10.0 109.842 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' B' ' 57' ' ' LEU . 5.5 mp0 -56.78 -31.03 64.24 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.365 0.505 . . . . 10.0 112.365 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -17.38 64.68 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . 49.5 m -79.43 142.59 35.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.71 0.29 . . . . 10.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 56' ' ' THR . 25.2 p -90.47 167.11 12.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.798 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.417 ' HB ' ' HA ' ' B' ' 53' ' ' ASP . 77.3 t -65.12 -32.59 58.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.014 178.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.01 -38.07 89.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.064 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.95 -31.18 72.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.935 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.882 HD11 HD21 ' B' ' 57' ' ' LEU . 85.5 mt -64.85 -42.22 95.07 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.58 -36.12 79.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.648 -0.706 . . . . 10.0 110.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -63.03 -37.61 87.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.2 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 64.6 mt -69.28 -47.8 71.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.538 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.23 -39.4 80.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.638 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -58.79 -38.29 78.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.031 -0.531 . . . . 10.0 111.377 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.25 -11.83 84.65 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.809 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 72.3 mt -103.22 -51.51 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.865 0.364 . . . . 10.0 111.474 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 41.2 mt -84.25 -16.0 44.79 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.494 0.553 . . . . 10.0 112.494 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 mttt 62.05 45.45 7.23 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.531 0.681 . . . . 10.0 110.609 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' B' ' 37' ' ' ARG . 53.4 mtt-85 -133.3 143.66 49.13 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.529 -0.76 . . . . 10.0 109.972 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.79 131.6 46.59 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.12 2.547 . . . . 10.0 112.755 -179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.05 -16.68 36.4 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.872 2.381 . . . . 10.0 112.036 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.64 -28.21 69.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.434 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -104.93 13.34 31.22 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.82 0.343 . . . . 10.0 111.812 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -92.48 127.68 38.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.865 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' B' ' 78' ' ' ALA . 43.1 mmt-85 -117.37 111.76 19.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.416 -0.357 . . . . 10.0 110.616 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.1 mt -95.97 113.64 25.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.556 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -109.45 115.96 30.92 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.236 0.541 . . . . 10.0 112.435 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -115.43 127.27 55.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.404 -0.816 . . . . 10.0 108.919 178.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 61.91 35.87 16.11 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.51 0.506 . . . . 10.0 110.946 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.15 9.11 7.21 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.16 -0.927 . . . . 10.0 112.394 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -119.7 160.33 22.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.142 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 tp -85.66 139.0 31.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.644 0.259 . . . . 10.0 110.882 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -79.51 170.72 16.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.882 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -112.88 120.47 41.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.945 0.402 . . . . 10.0 110.754 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 24' ' ' VAL . 0.9 OUTLIER -64.04 -25.99 68.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.297 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.88 13.33 66.29 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.813 -0.708 . . . . 10.0 113.179 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -126.77 155.17 43.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.034 0.445 . . . . 10.0 111.349 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' B' ' 23' ' ' THR . 24.8 p -87.25 168.58 13.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.166 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.882 HD21 HD11 ' B' ' 27' ' ' LEU . 51.3 mt -60.79 -39.66 89.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.838 0.351 . . . . 10.0 110.654 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.8 -27.71 67.09 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.851 -0.613 . . . . 10.0 112.623 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.0 -26.56 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.061 0.457 . . . . 10.0 110.782 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 61.0 m -82.46 2.78 31.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.846 -0.615 . . . . 10.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.22 15.95 59.88 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.906 -0.664 . . . . 10.0 113.018 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' B' ' 57' ' ' LEU . 41.3 m-85 -86.61 87.39 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.818 0.342 . . . . 10.0 110.789 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 41.2 p -108.8 170.26 8.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 33.9 m -70.62 -3.78 19.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.079 0.466 . . . . 10.0 111.113 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -88.36 -43.17 11.7 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -79.05 -30.45 44.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.073 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' ALA . . . . . 0.517 ' HB1' ' H ' ' B' ' 4' ' ' PHE . . . -118.41 106.57 12.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.03 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.5 ' HB3' ' HD2' ' B' ' 69' ' ' PRO . 64.0 mtt180 -113.01 160.08 32.26 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.806 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' B' ' 68' ' ' ARG . 12.1 Cg_endo -55.85 -24.47 47.43 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.987 2.458 . . . . 10.0 113.025 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.487 ' HB3' ' HB2' ' C' ' 61' ' ' TYR . 0.0 OUTLIER -115.55 12.97 16.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.707 0.289 . . . . 10.0 111.351 179.396 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -152.83 82.71 4.94 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.741 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.539 ' HB2' ' HB2' ' B' ' 6' ' ' MET . 4.3 Cg_exo -76.03 133.02 14.65 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.884 2.389 . . . . 10.0 111.726 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 114.7 5.69 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.41 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.56 125.1 26.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.11 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.65 ' HB ' HD13 ' B' ' 7' ' ' ILE . 47.1 t -124.06 131.01 73.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.934 -0.765 . . . . 10.0 108.934 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.27 133.26 11.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.617 -0.801 . . . . 10.0 111.625 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.2 tp -114.7 108.51 16.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.0 0.429 . . . . 10.0 111.453 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.582 ' HB3' ' HB2' ' B' ' 43' ' ' ARG . . . -102.2 141.01 35.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.001 -0.741 . . . . 10.0 109.001 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -119.56 121.63 39.79 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -76.19 96.85 3.99 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.274 0.559 . . . . 10.0 111.456 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -115.43 120.89 41.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.224 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -57.93 132.5 53.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.256 -0.429 . . . . 10.0 111.962 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.28 4.34 4.5 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.369 -0.832 . . . . 10.0 112.693 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 108.79 20.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.11 0.481 . . . . 10.0 110.031 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -82.73 -7.98 59.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.804 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.473 ' O ' HG13 ' B' ' 90' ' ' ILE . 39.0 tt0 -58.45 -29.36 66.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.321 179.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.8 -38.96 79.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.446 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.04 -27.9 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.539 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 35.0 m -77.14 -26.94 53.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.955 0.407 . . . . 10.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.75 HG12 ' HB2' ' B' ' 10' ' ' HIS . 19.0 mt -88.2 -21.16 7.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.45 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' B' ' 92' ' ' PRO . 46.0 tt0 -76.23 112.56 21.61 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.92 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' B' ' 95' ' ' SER . 13.2 Cg_exo -71.63 -7.85 22.01 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.043 2.495 . . . . 10.0 111.959 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.57 -19.13 46.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.163 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -121.39 -35.81 3.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.082 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' SER . . . . . 0.613 ' O ' ' HA ' ' B' ' 92' ' ' PRO . 8.9 m -119.58 143.71 35.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.106 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 41.6 Cg_endo -70.19 142.84 47.05 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.326 2.018 . . . . 10.0 111.143 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' PRO . 78.5 Cg_exo -49.82 128.4 21.48 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.182 2.588 . . . . 10.0 112.625 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -65.9 111.67 3.41 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.033 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.442 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 12.5 tp -137.42 134.91 18.82 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.509 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' B' ' 99' ' ' LEU . 23.9 Cg_exo -65.87 131.09 26.27 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.867 2.378 . . . . 10.0 112.17 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -69.67 -29.69 67.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.092 0.472 . . . . 10.0 110.577 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.439 HG23 ' HG2' ' B' ' 103' ' ' MET . 31.6 m -71.52 -13.01 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.192 0.52 . . . . 10.0 110.76 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.478 ' HA ' ' NE2' ' B' ' 106' ' ' GLN . 83.9 mmm -116.56 17.58 15.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.781 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.604 ' HB3' ' HD3' ' B' ' 105' ' ' PRO . 79.9 tttt -85.25 -54.28 0.44 Allowed Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 112.796 0.665 . . . . 10.0 112.796 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' B' ' 104' ' ' LYS . 7.8 Cg_exo -74.15 73.18 3.87 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.208 1.939 . . . . 10.0 111.747 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' GLN . . . . . 0.478 ' NE2' ' HA ' ' B' ' 103' ' ' MET . 29.4 mt-30 -139.61 162.39 35.21 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.25 167.75 15.36 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.874 0.368 . . . . 10.0 111.804 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 131.91 34.28 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.258 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . -85.38 -154.99 23.92 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.902 -0.665 . . . . 10.0 112.552 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 1.3 p -89.32 -32.63 17.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.978 0.418 . . . . 10.0 111.149 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.538 ' HB2' ' HB2' ' B' ' 114' ' ' GLU . 36.2 m -89.11 163.73 15.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.371 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.71 129.13 38.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.487 -0.56 . . . . 10.0 109.487 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 68.85 15.18 8.95 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.645 0.591 . . . . 10.0 111.62 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.538 ' HB2' ' HB2' ' B' ' 111' ' ' SER . 32.8 tt0 -81.58 121.64 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -103.12 132.91 49.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.828 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -110.72 109.0 19.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 1.6 t -78.61 128.36 38.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 10.0 111.68 179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.766 0.317 . . . . 10.0 111.446 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -123.08 113.63 19.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.382 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.692 ' HB2' ' HB2' ' C' ' 11' ' ' PHE . 28.2 mt -83.84 133.3 34.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.167 -0.47 . . . . 10.0 109.845 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 40.2 mt -117.92 108.82 25.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 5.2 p -83.61 166.47 18.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.061 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -14.49 60.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 10.0 111.755 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 7' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -86.29 -2.64 58.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 10.0 110.604 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.8 23.8 59.24 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.006 -0.616 . . . . 10.0 111.922 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.85 127.58 44.81 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -94.26 136.49 34.49 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.796 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 11' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' C' ' 3' ' ' LEU . 96.7 m-85 -123.92 102.5 7.81 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.873 0.368 . . . . 10.0 111.207 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 12' ' ' ILE . . . . . 0.616 ' HB ' ' HA ' ' B' ' 14' ' ' ILE . 15.8 mm -87.15 115.04 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 13' ' ' VAL . . . . . . . . . . . . . 18.4 t -102.82 139.24 24.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.587 -0.279 . . . . 10.0 110.291 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.979 ' HD2' ' HB3' ' B' ' 17' ' ' ASP . 49.0 tttt -62.38 133.57 55.24 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' C' ' 19' ' ' LEU . 45.0 ttt180 -55.34 -35.86 65.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.869 -179.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.468 ' HB3' ' HD3' ' C' ' 14' ' ' LYS . 62.2 tt0 -54.04 -44.21 70.82 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.102 0.477 . . . . 10.0 110.953 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -81.16 -43.08 19.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.622 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.11 74.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.929 -0.578 . . . . 10.0 112.361 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' C' ' 15' ' ' ARG . 86.5 mt -64.81 -41.06 96.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.86 0.362 . . . . 10.0 110.765 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 20' ' ' THR . . . . . 0.407 HG21 HG13 ' C' ' 63' ' ' VAL . 3.8 m -65.64 -48.23 72.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 21' ' ' SER . . . . . . . . . . . . . 12.3 m -61.01 -33.73 73.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.859 0.362 . . . . 10.0 110.873 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.09 -9.4 71.62 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 121.052 -0.594 . . . . 10.0 112.345 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 6.0 m -99.44 2.16 44.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.515 0.674 . . . . 10.0 110.052 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.66 160.48 5.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 179.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 25' ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 7' ' ' SER . 76.2 tttt -64.95 101.27 0.48 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.9 0.381 . . . . 10.0 111.144 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 7' ' ' SER . . . -120.76 166.92 13.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.161 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 27' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' C' ' 91' ' ' PHE . 53.6 mmm -76.86 34.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mp -71.61 -25.19 62.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.119 0.485 . . . . 10.0 110.361 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -94.0 16.71 13.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.384 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . 0.452 ' N ' ' HD2' ' C' ' 31' ' ' PRO . . . -83.74 -56.88 2.53 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.42 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 31' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' C' ' 30' ' ' GLY . 26.9 Cg_endo -62.03 166.98 11.39 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.602 2.202 . . . . 10.0 112.706 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.53 92.81 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.887 -0.597 . . . . 10.0 113.069 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -152.93 114.79 4.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.81 0.338 . . . . 10.0 110.306 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 34' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -82.31 79.74 8.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.099 -0.5 . . . . 10.0 109.842 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.28 163.06 28.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.273 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 36' ' ' GLU . . . . . 0.404 ' HA ' ' OG1' ' C' ' 39' ' ' THR . 33.2 mt-10 -59.67 -19.5 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -64.22 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.518 -0.919 . . . . 10.0 108.518 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 38' ' ' GLU . . . . . 0.504 ' O ' HG22 ' C' ' 42' ' ' VAL . 1.0 OUTLIER -69.31 -20.33 63.88 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.395 -0.82 . . . . 10.0 110.547 179.611 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 39' ' ' THR . . . . . 0.404 ' OG1' ' HA ' ' C' ' 36' ' ' GLU . 2.7 m -74.53 -30.77 61.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.02 0.438 . . . . 10.0 110.647 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -94.06 -55.78 3.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.164 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.22 92.95 4.27 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.879 -0.786 . . . . 10.0 108.879 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.576 ' HB ' HD23 ' C' ' 3' ' ' LEU . 1.6 t -85.82 97.01 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.172 -178.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -84.09 111.65 19.51 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.927 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.443 ' HB3' HD12 ' C' ' 47' ' ' ILE . 3.0 m-85 -115.72 109.94 18.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 45' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -96.74 163.45 12.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.191 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 69.53 7.17 6.09 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.525 0.516 . . . . 10.0 111.72 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 47' ' ' ILE . . . . . 0.443 HD12 ' HB3' ' C' ' 44' ' ' PHE . 60.1 mt -122.76 106.22 34.71 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.121 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 48' ' ' PRO . . . . . 0.5 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 45.9 Cg_exo -58.6 145.02 96.76 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.874 2.383 . . . . 10.0 112.024 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 5.7 p -58.35 -41.29 84.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.503 -179.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -54.95 -55.64 28.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.917 -0.583 . . . . 10.0 112.361 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 51' ' ' VAL . . . . . . . . . . . . . 34.6 m -67.62 -34.41 67.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 121.077 -0.249 . . . . 10.0 111.61 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.08 -33.51 75.93 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.856 0.36 . . . . 10.0 110.287 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 39.2 m -61.89 -39.75 93.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.403 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -65.68 -37.67 87.13 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.314 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 55.2 t -63.99 -44.88 97.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.575 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 56' ' ' CYS . . . . . . . . . . . . . 56.3 m -61.18 -39.65 90.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.649 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 57' ' ' MET . . . . . . . . . . . . . 64.9 mtm -68.29 -38.04 81.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 58' ' ' TYR . . . . . 0.618 ' HE2' ' HB3' ' A' ' 11' ' ' LEU . 76.4 t80 -63.35 -44.11 95.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.76 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 59' ' ' PHE . . . . . 0.41 ' O ' HG23 ' C' ' 63' ' ' VAL . 8.4 m-85 -63.44 -42.92 98.67 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.912 -0.403 . . . . 10.0 109.912 179.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 78.9 m -59.05 -43.75 91.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.839 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.487 ' HB2' ' HB3' ' B' ' 70' ' ' GLN . 53.7 t80 -66.29 -43.6 85.88 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.496 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -60.87 -41.17 95.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.666 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 63' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 59' ' ' PHE . 50.5 t -57.58 -47.14 85.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 10.0 110.392 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -75.11 -40.44 59.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.707 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 65' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' C' ' 69' ' ' SER . 87.9 t80 -58.83 -43.39 90.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.66 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.79 18.79 4.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.148 0.499 . . . . 10.0 111.111 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 67' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -123.75 -68.82 0.85 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.028 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.48 -23.29 4.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.969 0.414 . . . . 10.0 111.842 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.795 ' HB2' ' HA ' ' C' ' 65' ' ' TYR . 12.3 m -84.46 27.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.207 0.527 . . . . 10.0 111.808 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.2 -0.32 40.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.26 0.552 . . . . 10.0 110.606 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.86 -17.21 33.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.803 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 33.4 pt -103.44 163.3 17.71 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.836 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -69.16 168.91 19.41 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.928 2.419 . . . . 10.0 112.403 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -70.05 166.87 18.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.082 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 75' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' C' ' 76' ' ' PRO . 53.1 t80 -52.12 130.01 40.56 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.859 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 76' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' C' ' 75' ' ' PHE . 38.6 Cg_exo -58.49 124.14 15.17 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.809 2.339 . . . . 10.0 112.115 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 77' ' ' ILE . . . . . 0.946 HG22 ' HA ' ' A' ' 16' ' ' LEU . 11.1 pt -78.19 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.341 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' C' ' 79' ' ' PRO . . . -99.85 -55.84 0.16 Allowed Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 112.632 0.604 . . . . 10.0 112.632 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 79' ' ' PRO . . . . . 0.619 ' HD3' ' HB3' ' C' ' 78' ' ' ALA . 17.4 Cg_exo -68.41 103.71 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.25 1.967 . . . . 10.0 111.483 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 80' ' ' GLU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 3.7 pt-20 -74.58 58.68 0.79 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.511 0.559 . . . . 10.0 112.511 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 14.8 mm -122.2 -4.73 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.187 0.517 . . . . 10.0 110.796 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 82' ' ' ALA . . . . . 0.582 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -69.38 -34.62 74.82 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.155 -0.34 . . . . 10.0 111.582 -179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 83' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 19.3 tp -68.21 -33.2 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 84' ' ' GLU . . . . . 0.562 ' HG3' ' HG ' ' A' ' 32' ' ' LEU . 16.8 mp0 -63.01 -36.51 83.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.219 -0.9 . . . . 10.0 109.663 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.772 ' HB3' HD21 ' A' ' 8' ' ' LEU . 76.6 mt -74.39 -34.14 63.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.425 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 86' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -68.26 -17.3 64.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.421 -0.808 . . . . 10.0 110.83 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 87' ' ' MET . . . . . . . . . . . . . 30.0 ttp -63.67 -18.27 63.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.286 -0.415 . . . . 10.0 110.793 179.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.51 75.99 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.477 -0.564 . . . . 10.0 109.477 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . 66.71 -68.49 0.14 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.373 -0.831 . . . . 10.0 112.962 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 90' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -80.85 47.52 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.345 0.593 . . . . 10.0 111.266 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 91' ' ' PHE . . . . . 0.541 ' HA ' ' HG3' ' C' ' 27' ' ' MET . 10.6 t80 . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 179.695 . . . . . . . . 1 1 . 1 stop_ save_